##TITLE=Neopentyl isothiocyanate
##JCAMP-DX=4.24
##DATA TYPE=INFRARED SPECTRUM
##ORIGIN=EPA-IR VAPOR PHASE LIBRARY
##OWNER=SRD/NIST
Collection (C) 2018 copyright by the U.S. Secretary of Commerce
on behalf of the United States of America. All rights reserved.
##CAS REGISTRY NO=597-97-7
##MOLFORM=C 6 H 11 N S
##$NIST SOURCE=MSDC-IR
##STATE=gas
##XUNITS=1/CM
##YUNITS=ABSORBANCE
##XFACTOR=1.
##YFACTOR=0.001
##DELTAX=1.92898
##FIRSTX=549.8
##LASTX=4000.7
##FIRSTY=5.94
##MAXX=4000.7
##MINX=549.759
##MAXY=0.36658
##MINY=0
##NPOINTS=1790
##XYDATA=(X++(Y..Y))
549.759 5.94 5.47 5.1 4.94 4.72 4.27 3.88 3.94 3.8 3.42
569.049 3.42 3.43 3.42 3.28 3.02 2.87 3.04 2.98 2.73 2.9
588.339 2.92 2.95 3.04 3.17 3.04 2.9 3.14 3.19 3.11 2.99
607.628 3.06 3.07 2.85 2.6 2.4 2.28 2.12 2.03 2 1.96
626.918 1.82 1.62 1.53 1.53 1.53 1.5 1.37 1.1922 1.2167 1.2344
646.208 1.239 1.2146 1.1476 1.0604 1.0764 1.0919 1.0194 1.1648 1.3253 1.38
665.498 1.46 1.6 1.92 2.25 2.69 3.19 3.64 4.11 4.63 5.43
684.787 6.16 6.91 7.89 8.82 9.61 10.3 11.07 11.94 12.59 12.89
704.077 13.27 13.47 13.36 13.28 13.23 13.2 13.29 13.58 13.77 13.81
723.367 13.82 13.63 13.59 13.65 13.48 12.98 12.56 11.92 10.74 9.68
742.657 8.43 7.36 6.61 5.53 4.39 3.48 2.88 2.63 2.44 2.18
761.947 1.87 1.79 1.66 1.5 1.44 1.3062 1.1489 1.0968 1.2726 1.2415
781.236 1.0185 0.958 1.0148 0.9939 0.8554 0.6864 0.7402 0.7687 0.6518 0.5354
800.526 0.34391 0.41935 0.4873 0.34029 0.4447 0.5145 0.3801 0.36563 0.3855 0.211
819.816 0.126 0.141 0.309 0.4741 0.172 0 0.096 0.146 0.186 0.2657
839.106 0.168 0.09 0.219 0.32233 0.496 0.6288 0.7402 0.8902 0.9005 1.0552
858.395 1.35 1.41 1.4 1.63 1.85 1.81 1.85 2.15 2.4 2.53
877.685 2.66 3.15 3.79 4.32 5.07 6.02 7.15 8.23 9.01 9.55
896.975 10 10.23 10.39 10.4 10.06 9.34 8.49 7.53 6.62 6.03
916.265 5.46 5.02 4.71 4.52 4.33 4.22 4.22 4.23 4.11 4.1
935.555 3.94 3.69 3.61 3.37 3.17 3.04 2.87 2.52 2.23 2.01
954.844 1.83 1.8 1.79 1.66 1.49 1.42 1.4 1.48 1.41 1.1925
974.134 1.2368 1.2916 1.1387 1.1946 1.36 1.3177 1.1443 1.2701 1.33 1.1909
993.424 1.1488 1.0251 1.0256 1.0704 1.1595 1.1671 1.2752 1.35 1.1999 1.0415
1012.714 1.0299 1.1637 1.1594 1.2749 1.48 1.59 1.72 1.8 1.68 1.61
1032.003 1.48 1.6 1.86 1.77 1.84 1.9 2.07 2.21 2.25 2.19
1051.293 2.14 2.25 2.35 2.46 2.19 2.13 2.56 2.7 2.63 2.37
1070.583 2.11 2.25 2.35 2.13 2.22 2.15 1.56 1.52 1.82 1.5
1089.873 1.2464 1.36 1.49 1.59 1.38 1.33 1.76 1.8 1.42 1.4
1109.163 1.46 1.79 1.8 1.75 2.06 2.1 2.16 2.09 1.99 2.22
1128.452 2.66 2.64 2.55 2.96 3.19 3.02 2.74 2.49 1.98 2.04
1147.742 2.25 2.14 2.39 2.47 2.46 2.42 2.39 2.67 2.79 3
1167.032 3.22 3.28 3.5 3.7 3.68 3.68 3.73 4.02 4.17 4.32
1186.322 4.88 5.02 5.5 6.31 7.13 8.02 8.72 9.73 10.9 11.84
1205.611 12.57 12.93 13.12 13 12.39 11.62 11.03 10.19 9.11 8.21
1224.901 7.28 6.82 6.63 6.64 7.06 7.46 8.28 9.28 10.05 10.79
1244.191 11.43 11.59 11.54 11.5 11.25 10.76 10.14 9.57 8.58 7.61
1263.481 6.89 6.1 5.52 5.15 5.01 4.91 4.84 4.98 5.06 5.1
1282.771 5.15 5.39 5.7 5.77 5.89 6.08 6.19 6.18 6.17 6.42
1302.060 6.73 7.01 7.51 8.29 9.3 10.66 12.42 14.69 17.46 20.71
1321.350 24.43 28.39 32.36 35.97 38.92 41.07 42.44 42.96 42.53 41.12
1340.640 38.69 35.47 31.86 28.33 25.21 22.43 19.95 17.91 16.48 15.63
1359.930 15.42 15.7 16.34 17.21 18.16 18.95 19.51 19.89 20.07 19.93
1379.219 19.3 18.4 17.5 16.84 16.65 17.02 17.98 19.48 21.13 22.41
1398.509 22.85 22.61 22.01 21.38 21.02 20.11 17.75 14.41 11.17 8.72
1417.799 7.2 6.36 5.97 5.85 5.93 6.27 6.87 7.67 8.95 10.77
1437.089 13.09 15.67 18.26 20.79 23.15 25.33 27.01 27.93 28.16 27.75
1456.378 26.79 25.51 23.99 22.08 20.14 18.6 17.78 17.72 18.16 18.75
1475.668 19.12 19.08 18.65 18.08 17.41 16.57 15.46 14.03 12.33 10.51
1494.958 8.9 7.55 6.41 5.49 4.75 4.16 3.65 3.29 2.95 2.6
1514.248 2.39 2.23 2.08 1.94 1.79 1.7 1.55 1.43 1.43 1.38
1533.538 1.2706 1.2569 1.256 1.253 1.226 1.1258 1.0638 1.0636 1.0489 1.0444
1552.827 1.0167 0.9854 1.0103 1.0322 1.057 1.0123 0.9881 1.0122 1.0185 0.9817
1572.117 1.0041 1.1282 1.0971 1.0346 0.9559 0.9892 1.0962 1.0835 1.0519 0.9621
1591.407 1.0027 1.1144 1.1345 1.097 1.1156 1.1093 1.0505 1.0845 1.0719 1.0191
1610.697 1.0817 1.122 1.1348 1.1131 1.0832 1.1149 1.1053 1.099 1.1272 1.1697
1629.986 1.2125 1.222 1.2399 1.2434 1.2274 1.2026 1.1372 1.1563 1.212 1.1951
1649.276 1.1523 1.1637 1.1444 1.0959 1.1171 1.1131 1.0857 1.0971 1.1323 1.1201
1668.566 1.0388 1.0515 1.1061 1.1223 1.106 1.0421 1.0274 1.051 1.0887 1.1016
1687.856 1.0819 1.0635 1.0864 1.1538 1.1586 1.1165 1.1711 1.2135 1.2209 1.2671
1707.146 1.2584 1.2654 1.3184 1.3039 1.2767 1.2438 1.2336 1.2336 1.2178 1.2688
1726.435 1.2706 1.2502 1.2932 1.3098 1.2832 1.2963 1.31 1.2693 1.2227 1.2974
1745.725 1.34 1.33 1.35 1.35 1.3132 1.258 1.2834 1.33 1.3037 1.2435
1765.015 1.2253 1.1938 1.1459 1.1888 1.1998 1.1379 1.0871 1.051 1.07 1.0728
1784.305 1.1199 1.1783 1.1656 1.1724 1.2127 1.2559 1.2929 1.3 1.2689 1.2622
1803.594 1.2185 1.1436 1.138 1.1029 1.0306 1.0335 1.0388 0.9891 0.9692 1.0583
1822.884 1.1351 1.1432 1.0976 1.0659 1.1407 1.2194 1.2648 1.2594 1.2901 1.3236
1842.174 1.2606 1.231 1.2971 1.35 1.39 1.45 1.5 1.55 1.56 1.65
1861.464 1.77 1.82 1.91 1.97 2.03 2.13 2.23 2.33 2.42 2.55
1880.754 2.65 2.7 2.79 2.93 3.07 3.24 3.37 3.45 3.58 3.76
1900.043 3.89 4.03 4.24 4.45 4.68 4.87 5.11 5.43 5.7 5.98
1919.333 6.37 6.75 7.05 7.46 7.97 8.42 8.82 9.34 9.95 10.59
1938.623 11.23 11.93 12.62 13.27 13.96 14.69 15.44 16.25 17.02 17.81
1957.913 18.76 19.73 20.72 21.77 22.89 24.07 25.31 26.63 28 29.48
1977.202 31.07 32.73 34.46 36.29 38.18 40.14 42.16 44.29 46.56 48.82
1996.492 51.27 53.95 56.78 59.88 63.16 66.74 70.83 75.29 80.18 85.59
2015.782 91.51 98 105.1 112.8 121.09 130.01 139.43 149.51 160.17 171.24
2035.072 182.84 195 207.61 220.47 233.58 246.88 260.17 273.26 286.06 298.4
2054.362 310.06 320.87 330.59 339.22 346.85 353.27 358.51 362.46 365.04 366.48
2073.651 366.58 365.12 362.36 358.28 352.78 345.99 337.64 327.29 314.58 299.63
2092.941 282.42 263.08 242.39 221.14 199.96 179.66 160.9 144.05 129.24 116.57
2112.231 105.93 97.18 90.03 84.29 79.7 76 73.1 70.88 69.43 68.57
2131.521 68.26 68.62 69.54 70.78 72.28 73.93 75.33 76.27 76.62 76.29
2150.810 75.25 73.58 71.31 68.5 65.23 61.85 58.48 55.29 52.66 50.65
2170.100 49.26 48.45 48.12 48.19 48.53 49.17 50.07 51.01 52.06 53.14
2189.390 54.29 55.4 56.26 56.93 57.41 57.68 57.59 57.13 56.32 55.14
2208.680 53.62 51.79 49.63 47.23 44.66 41.92 39.11 36.24 33.47 30.91
2227.970 28.47 26.2 24.17 22.29 20.61 19.24 18 16.79 15.79 14.9
2247.259 14.09 13.37 12.67 11.93 11.26 10.72 10.19 9.7 9.29 8.94
2266.549 8.64 8.4 8.18 7.87 7.61 7.33 7.06 6.83 6.51 6.11
2285.839 5.71 5.38 5.04 4.74 4.5 4.27 4.1 3.92 3.79 3.62
2305.129 3.53 3.47 3.39 3.29 3.16 3.05 2.9 2.78 2.65 2.52
2324.418 2.45 2.41 2.36 2.29 2.17 2.09 2.01 1.93 1.9 1.93
2343.708 1.96 1.88 1.83 1.8 1.73 1.71 1.72 1.73 1.7 1.7
2362.998 1.76 1.68 1.65 1.67 1.72 1.79 1.75 1.77 1.82 1.8
2382.288 1.79 1.83 1.83 1.77 1.78 1.87 1.92 1.93 1.93 1.91
2401.578 1.88 1.86 1.79 1.68 1.73 1.72 1.7 1.73 1.66 1.56
2420.867 1.47 1.45 1.46 1.43 1.41 1.37 1.3065 1.308 1.2801 1.1598
2440.157 1.1236 1.1542 1.1219 1.1194 1.0979 1.0719 1.1643 1.1893 1.0924 1.1006
2459.447 1.1566 1.1406 1.1725 1.2095 1.2009 1.1654 1.2087 1.2619 1.2698 1.3249
2478.737 1.39 1.39 1.41 1.44 1.45 1.47 1.46 1.5 1.57 1.6
2498.026 1.52 1.52 1.61 1.72 1.71 1.65 1.68 1.66 1.67 1.71
2517.316 1.7 1.75 1.8 1.84 1.83 1.8 1.83 1.8 1.78 1.83
2536.606 1.9 1.9 1.83 1.87 1.97 2.03 2.05 2.06 2.06 2.14
2555.896 2.13 2.12 2.22 2.27 2.3 2.34 2.4 2.43 2.42 2.36
2575.186 2.39 2.45 2.55 2.63 2.66 2.72 2.75 2.83 2.92 2.96
2594.475 2.97 3.05 3.06 2.99 2.96 2.89 2.85 2.79 2.72 2.65
2613.765 2.51 2.38 2.39 2.42 2.29 2.16 2.15 2.04 1.91 1.85
2633.055 1.83 1.78 1.77 1.73 1.71 1.81 1.84 1.86 1.94 1.92
2652.345 1.92 1.9 1.84 1.86 1.85 1.9 1.84 1.69 1.64 1.6
2671.634 1.54 1.56 1.6 1.45 1.38 1.43 1.43 1.37 1.3099 1.4
2690.924 1.41 1.46 1.54 1.5 1.48 1.5 1.62 1.66 1.63 1.67
2710.214 1.74 1.79 1.8 1.8 1.85 1.95 2.02 2.12 2.19 2.24
2729.504 2.34 2.49 2.71 2.75 2.74 2.86 2.83 2.77 2.99 3.15
2748.794 3.16 3.26 3.39 3.52 3.6 3.68 3.83 4.08 4.25 4.33
2768.083 4.51 4.69 4.9 5.1 5.21 5.44 5.61 5.59 5.71 5.96
2787.373 6.14 6.29 6.43 6.54 6.52 6.46 6.44 6.43 6.36 6.21
2806.663 6.02 5.75 5.63 5.62 5.59 5.54 5.53 5.55 5.52 5.53
2825.953 5.54 5.53 5.68 5.85 6.04 6.2 6.33 6.53 6.79 7.13
2845.242 7.39 7.79 8.37 9.11 10.07 11.02 12.13 13.7 15.68 17.89
2864.532 20.25 22.81 25.47 27.91 30.06 31.74 33 33.88 34.24 34.16
2883.822 33.72 32.87 31.9 31.05 30.41 29.97 29.6 29.39 29.44 29.63
2903.112 29.91 30.33 31.04 31.8 32.69 33.96 35.26 36.68 38.36 40.26
2922.401 42.29 44.42 46.63 48.96 51.16 53.17 54.93 56.36 57.71 58.96
2941.691 60 61.26 62.62 64.21 66.33 68.76 71.72 75.1 78.89 83
2960.981 87.25 91.81 96.38 100.77 104.56 106.58 105.8 101.77 95.43 88.32
2980.271 80.37 71.58 61.65 50.16 38.67 28.86 21.63 16.74 13.33 10.94
2999.561 9.25 8.03 7.03 6.3 5.82 5.39 5 4.6 4.32 4.03
3018.850 3.77 3.59 3.23 2.9 2.72 2.54 2.38 2.21 2.11 2.05
3038.140 1.82 1.69 1.67 1.59 1.6 1.66 1.73 1.74 1.74 1.67
3057.430 1.65 1.67 1.57 1.57 1.76 1.83 1.81 1.88 1.86 1.8
3076.720 1.84 1.86 1.95 2.02 1.99 2.04 1.95 1.95 1.99 2
3096.009 2.19 2.23 2.03 1.95 2.02 1.99 1.96 1.92 1.85 1.79
3115.299 1.67 1.67 1.6 1.4 1.39 1.56 1.67 1.52 1.46 1.5
3134.589 1.48 1.48 1.51 1.48 1.5 1.54 1.52 1.38 1.2868 1.42
3153.879 1.48 1.44 1.33 1.37 1.43 1.45 1.45 1.42 1.33 1.34
3173.169 1.329 1.2887 1.5 1.66 1.66 1.57 1.55 1.66 1.61 1.48
3192.458 1.43 1.45 1.58 1.69 1.61 1.58 1.51 1.43 1.51 1.59
3211.748 1.55 1.51 1.58 1.54 1.5 1.48 1.4 1.2742 1.2819 1.2671
3231.038 1.0177 1.0144 1.1454 0.9326 0.8019 0.781 0.748 0.7687 0.7023 0.5643
3250.328 0.5955 0.5892 0.5472 0.5491 0.5875 0.6854 0.609 0.5689 0.5574 0.5411
3269.617 0.4895 0.4559 0.5196 0.5188 0.4613 0.42208 0.5008 0.6307 0.736 0.6892
3288.907 0.6406 0.6504 0.6109 0.5951 0.6095 0.6621 0.6068 0.5725 0.6104 0.6692
3308.197 0.6949 0.7749 0.8307 0.5833 0.34733 0.39015 0.4735 0.4451 0.3143 0.36567
3327.487 0.36438 0.3061 0.38609 0.330598 0.41282 0.5237 0.5252 0.626 0.5927 0.5644
3346.777 0.5606 0.5668 0.4986 0.4886 0.7378 0.7519 0.5949 0.4716 0.5058 0.6128
3366.066 0.7075 0.7593 0.7782 0.6895 0.6328 0.7161 0.5615 0.4892 0.5749 0.5475
3385.356 0.5192 0.5647 0.5173 0.4451 0.5434 0.5501 0.4194 0.479 0.6487 0.6573
3404.646 0.5587 0.4341 0.39188 0.529 0.5507 0.4611 0.5057 0.4095 0.3096 0.253
3423.936 0.2558 0.36169 0.2574 0.2739 0.36296 0.2605 0.3067 0.37094 0.3018 0.2731
3443.225 0.42439 0.5075 0.4719 0.4849 0.4949 0.5194 0.39951 0.32773 0.40545 0.40344
3462.515 0.3459 0.2542 0.2669 0.3182 0.2863 0.5273 0.6235 0.42613 0.4793 0.5336
3481.805 0.4716 0.4669 0.5859 0.5829 0.2569 0.142 0.339502 0.39234 0.3919 0.32517
3501.095 0.2734 0.247 0.311 0.42671 0.39046 0.207 0.117 0.2728 0.32829 0.3152
3520.385 0.3718 0.35855 0.334384 0.37811 0.42072 0.35833 0.2914 0.34044 0.35325 0.183
3539.674 0.107 0.2683 0.3187 0.40615 0.4946 0.39006 0.33982 0.42253 0.36858 0.39198
3558.964 0.4564 0.40256 0.4797 0.4423 0.3003 0.2978 0.34067 0.2735 0.32172 0.41252
3578.254 0.3135 0.335581 0.4738 0.5447 0.5167 0.455 0.35395 0.2968 0.2743 0.191
3597.544 0.2305 0.39953 0.4822 0.4935 0.4939 0.5381 0.3917 0.173 0.148 0.32129
3616.833 0.4822 0.4915 0.4686 0.41011 0.32693 0.36995 0.4935 0.34528 0.2617 0.3088
3636.123 0.2457 0.32025 0.38049 0.32251 0.38251 0.5769 0.6357 0.4864 0.39289 0.3166
3655.413 0.32856 0.39746 0.41825 0.39699 0.37024 0.4378 0.41784 0.2852 0.39866 0.4551
3674.703 0.40533 0.5441 0.40455 0.228 0.32626 0.4807 0.4799 0.4836 0.4733 0.39299
3693.993 0.4537 0.36739 0.3163 0.4705 0.4464 0.42747 0.4392 0.3114 0.3109 0.36303
3713.282 0.5281 0.4903 0.4323 0.4562 0.39767 0.39554 0.35459 0.4331 0.4616 0.4451
3732.572 0.447 0.40068 0.37854 0.3194 0.2614 0.3069 0.4356 0.6246 0.5824 0.5516
3751.862 0.5917 0.5217 0.4509 0.4749 0.5755 0.5408 0.5367 0.5307 0.5649 0.6037
3771.152 0.55 0.5853 0.624 0.5916 0.4905 0.3152 0.35329 0.55 0.5896 0.6424
3790.441 0.6872 0.5978 0.563 0.5537 0.5772 0.609 0.5857 0.6696 0.7183 0.8438
3809.731 0.8587 0.7539 0.8356 0.7493 0.5395 0.5856 0.7194 0.6999 0.7092 0.7958
3829.021 0.7604 0.693 0.697 0.6831 0.5988 0.41322 0.5624 0.8944 0.8278 0.5982
3848.311 0.6727 0.8552 0.7135 0.6508 0.7486 0.7241 0.6681 0.7021 0.761 0.785
3867.601 0.9367 0.8457 0.7191 0.7397 0.5921 0.6736 0.9097 0.8417 0.8396 0.9893
3886.890 1.0593 0.9913 0.8448 0.8441 0.8736 0.7761 0.7486 0.814 0.779 0.7515
3906.180 0.7329 0.7403 0.7431 0.8021 0.837 0.7839 0.8666 0.8879 0.897 0.9193
3925.470 0.9349 0.9473 0.7085 0.625 0.7467 1.0085 1.1561 1.0291 0.9703 0.9288
3944.760 0.9919 0.966 0.9073 1.0239 1.0808 1.0401 0.9837 1.0672 0.9398 0.8848
3964.049 1.0061 1.0641 1.2352 1.2702 1.2278 1.1846 1.1919 1.1995 1.1274 1.1214
3983.339 1.2168 1.2957 1.2898 1.2275 1.34 1.2725 1.2188 1.255 1.2498 1.1819
##END=
