1,3-Dioxolane, 2-butyl-4-methyl-
- Formula: C8H16O2
- Molecular weight: 144.2114
- IUPAC Standard InChI: InChI=1S/C8H16O2/c1-3-4-5-8-9-6-7(2)10-8/h7-8H,3-6H2,1-2H3
- IUPAC Standard InChIKey: WTZJUXYVLRJTMQ-UHFFFAOYSA-N
- CAS Registry Number: 74094-60-3
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
The 3d structure may be viewed using Java or Javascript. - Other names: Pentanal propyleneglycol acetal; 1,3-Dioxolane, 4-methyl-2-butyl; 2-Butyl-4-methyl-1,3-dioxolane; 1,3-Dioxolane, 2-butyl-4-methyl, cis; 1,3-Dioxolane, 2-butyl-4-methyl, trans
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Mass spectrum (electron ionization)
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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director
Spectrum
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Additional Data
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| Owner | NIST Mass Spectrometry Data Center Collection (C) 2014 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. |
|---|---|
| Origin | Philip Morris R&D |
| NIST MS number | 109551 |
Gas Chromatography
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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director
Kovats' RI, non-polar column, isothermal
| Column type | Active phase | Temperature (C) | I | Reference | Comment |
|---|---|---|---|---|---|
| Capillary | OV-101 | 110. | 976. | Misharina, Golovnya, et al., 1992 | 50. m/0.32 mm/0.5 μm, He |
| Capillary | OV-101 | 130. | 979. | Misharina, Golovnya, et al., 1992 | 50. m/0.32 mm/0.5 μm, He |
| Capillary | OV-101 | 110. | 966. | Misharina, Golovnya, et al., 1992 | 50. m/0.32 mm/0.5 μm, He |
| Capillary | OV-101 | 130. | 969. | Misharina, Golovnya, et al., 1992 | 50. m/0.32 mm/0.5 μm, He |
| Packed | Apiezon L | 120. | 941. | Bogoslovsky, Anvaer, et al., 1978 | Celite 545 |
| Packed | Apiezon L | 160. | 956. | Bogoslovsky, Anvaer, et al., 1978 | Celite 545 |
Van Den Dool and Kratz RI, non-polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | OV-101 | 975. | Misharina, Golovnya, et al., 1992 | 50. m/0.32 mm/0.5 μm, He, 4. K/min; Tstart: 50. C; Tend: 200. C |
| Capillary | OV-101 | 965. | Misharina, Golovnya, et al., 1992 | 50. m/0.32 mm/0.5 μm, He, 4. K/min; Tstart: 50. C; Tend: 200. C |
Normal alkane RI, non-polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | CP Sil 8 CB | 945. | Wang, Guo, et al., 2004 | 30. m/0.32 mm/0.25 μm, 50. C @ 5. min, 5. K/min; Tend: 200. C |
References
Go To: Top, Mass spectrum (electron ionization), Gas Chromatography, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Misharina, Golovnya, et al., 1992
Misharina, T.A.; Golovnya, R.V.; Yakovleva, V.N.,
GC-MS and GC-FTIR characteristics of 2-alkyl- and 4-methyl-2-alkyl-1,3-dioxolans,
Zh. Anal. Khim., 1992, 47, 304-311. [all data]
Bogoslovsky, Anvaer, et al., 1978
Bogoslovsky, Yu.N.; Anvaer, B.I.; Vigdergauz, M.S.,
Chromatographic constants in gas chromatography (in Russian), Standards Publ. House, Moscow, 1978, 192. [all data]
Wang, Guo, et al., 2004
Wang, H.; Guo, Y.; Zhang, Z.; An, D.,
Fast analysis of volatile compounds in natural essences by automatic Static-Headspace-GC-MS,
J. Instrum. Anal. (Chinese), 2004, 23, 1, 9-13. [all data]
Notes
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