4,6-dimethyl-1,2,5-trithiepane

Formula: C₆H₁₂S₃
Molecular weight: 180.354
IUPAC Standard InChI: InChI=1S/C6H12S3/c1-5-3-7-8-4-6(2)9-5/h5-6H,3-4H2,1-2H3
IUPAC Standard InChIKey: NALUNDQPIYLHAN-UHFFFAOYSA-N
Chemical structure:
This structure is also available as a 2d Mol file
Species with the same structure:
- 1,2,5-Trithiepane, 4,6-dimethyl, #1
- 1,2,5-Trithiepane, 4,6-dimethyl, #2
Other names: 1,2,5-Trithiepane, 4,6-dimethyl
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Gas Chromatography

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director

Column type	Active phase	I	Reference	Comment
Capillary	DB-1	1442.	Yu, Wu, et al., 1994	60. m/0.25 mm/1.0 μm, He, 40. C @ 5. min, 2. K/min, 260. C @ 60. min
Capillary	DB-1	1454.	Yu, Wu, et al., 1994, 2	60. m/0.25 mm/1. μm, He, 40. C @ 5. min, 2. K/min, 260. C @ 60. min

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Yu, Wu, et al., 1994
Yu, T.-H.; Wu, C.-M.; Ho, C.-T., Meat-like flavor generated from thermal interactions of glucose and alliin or deoxyalliin, J. Agric. Food Chem., 1994, 42, 4, 1005-1009, https://doi.org/10.1021/jf00040a032 . [all data]

Yu, Wu, et al., 1994, 2
Yu, T.-H.; Wu, C.-M.; Rosen, R.T.; Hartman, T.G.; Ho, C.-T., Volatile compounds in generated from thermal degradation of alliin and deoxyalliin in an aqueous solution, J. Agric. Food Chem., 1994, 42, 1, 146-153, https://doi.org/10.1021/jf00037a026 . [all data]

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Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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