2-Methylpropyl (E)-isoferulate, TMS, ID: R42198 NIST 24032815242D 1 1.00000 0.00000 Copyright by the U.S. Sec. Commerce on behalf of U.S.A. All rights reserved. 22 22 0 0 0 1 V2000 4.5213 5.1658 0.0000 C 0 0 0 0 0 0 0 0 0 5.5268 5.1658 0.0000 C 0 0 0 0 0 0 0 0 0 6.0267 4.2999 0.0000 C 0 0 0 0 0 0 0 0 0 5.5268 3.4285 0.0000 C 0 0 0 0 0 0 0 0 0 4.5213 3.4285 0.0000 C 0 0 0 0 0 0 0 0 0 4.0160 4.2999 0.0000 C 0 0 0 0 0 0 0 0 0 3.0161 4.3048 0.0000 C 0 0 0 0 0 0 0 0 0 6.0267 2.5718 0.0000 O 0 0 0 0 0 0 0 0 0 7.0265 4.3048 0.0000 O 0 0 0 0 0 0 0 0 0 7.5208 5.1714 0.0000 C 0 0 0 0 0 0 0 0 0 6.0267 1.5720 0.0000 Si 0 0 0 0 0 0 0 0 0 5.0269 1.5720 0.0000 C 0 0 0 0 0 0 0 0 0 7.0265 1.5720 0.0000 C 0 0 0 0 0 0 0 0 0 6.0267 0.5722 0.0000 C 0 0 0 0 0 0 0 0 0 2.5106 3.4439 0.0000 C 0 0 0 0 0 0 0 0 0 1.5108 3.4439 0.0000 C 0 0 0 0 0 0 0 0 0 1.0109 4.3104 0.0000 O 0 0 0 0 0 0 0 0 0 1.0053 2.5829 0.0000 O 0 0 0 0 0 0 0 0 0 1.5052 1.7220 0.0000 C 0 0 0 0 0 0 0 0 0 0.9998 0.8610 0.0000 C 0 0 0 0 0 0 0 0 0 1.4997 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0.0000 0.8610 0.0000 C 0 0 0 0 0 0 0 0 0 1 6 2 0 0 0 2 1 1 0 0 0 3 2 2 0 0 0 4 3 1 0 0 0 5 4 2 0 0 0 6 5 1 0 0 0 6 7 1 0 0 0 4 8 1 0 0 0 3 9 1 0 0 0 9 10 1 0 0 0 8 11 1 0 0 0 11 12 1 0 0 0 11 13 1 0 0 0 11 14 1 0 0 0 7 15 2 0 0 0 15 16 1 0 0 0 16 17 2 0 0 0 16 18 1 0 0 0 18 19 1 0 0 0 19 20 1 0 0 0 20 21 1 0 0 0 20 22 1 0 0 0 M END