1,3,5-Trithiane, 2,4,6-trimethyl-

• Formula: C₆H₁₂S₃
• Molecular weight: 180.354
• IUPAC Standard InChI: InChI=1S/C6H12S3/c1-4-7-5(2)9-6(3)8-4/h4-6H,1-3H3 Copy

  
• IUPAC Standard InChIKey: XQVYLDFSPBXACS-UHFFFAOYSA-N Copy
• CAS Registry Number: 2765-04-0
• Chemical structure:
  This structure is also available as a 2d Mol file or as a computed 3d SD file
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• Species with the same structure:
  • 1,3,5-Trithiane, 2,4,6-trimethyl, #1
• Other names: S-Trithiane, 2,4,6-trimethyl-; Thioacetaldehyde trimer; Trithioacetaldehyde; 1,3,5-Trimethyl-S-trithiane; 2,4,6-Trimethyl-S-trithiane; 2,4,6-Trimethyl-1,3,5-trithiane; 1,3,5-Trimethyl-2,4,6-trithiane; Thioacetaldehyde cyclic trimer; 1,3,5-Trithiane, 2,4,6-trimethyl, #2; 2,4,6-Trimethyl-s-trithiane (trithioacetaldehyde)
• Information on this page:
  • Gas Chromatography
  • References
  • Notes
• Other data available:
  • Gas phase ion energetics data
  • Mass spectrum (electron ionization)
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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

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Van Den Dool and Kratz RI, non-polar column, temperature ramp

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References

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Garbuzov, Misharina, et al., 1985
Garbuzov, V.G.; Misharina, T.A.; Aerov, A.F.; Golovnya, R.V., Gas chromatographic retention indices for sulphur(II)-containing organic substances, J. Anal. Chem. USSR (Engl. Transl.), 1985, 40, 4, 576-586. [all data]

Zhang, Chien, et al., 1988
Zhang, Y.; Chien, M.; Ho.C.-T., Comparison of the volatile compounds obtained from thermal degradation of cysteine and glutathione in water, J. Agric. Food Chem., 1988, 36, 5, 992-996, https://doi.org/10.1021/jf00083a022 . [all data]

Notes

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• Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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