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trans-1-(5-Methyl-1,3-dithiolan-4-yl)-ethanone
SpectraBase Compound ID L5fB1BzfJqW
InChI InChI=1S/C6H10OS2/c1-4(7)6-5(2)8-3-9-6/h5-6H,3H2,1-2H3/t5-,6-/m1/s1
InChIKey HZWPXGFSBUZMKS-PHDIDXHHSA-N
Mol Weight 162.26 g/mol
Molecular Formula C6H10OS2
Exact Mass 162.017307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 87QOBZma52w
Name trans-1-(5-Methyl-1,3-dithiolan-4-yl)-ethanone
Classification 1,3-dithiolanes
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 162.017307289 u
Formula C6H10OS2
InChI InChI=1S/C6H10OS2/c1-4(7)6-5(2)8-3-9-6/h5-6H,3H2,1-2H3/t5-,6-/m1/s1
InChIKey HZWPXGFSBUZMKS-PHDIDXHHSA-N
Molecular Weight 162.265 g/mol
Number of Peaks 15
SMILES C1S[C@@]([C@@](C(=O)C)(S1)[H])(C)[H]
SPLASH splash10-01bi-9800000000-d32e6ac6c96786f8a978
Source of Spectrum FF-13-181-trans_7 (DOI: 10.1002_(SICI)1099-1026(199805_06)13_3_177)
Synonyms 1-((4R,5R)-5-methyl-1,3-dithiolan-4-yl)ethanone
Wiley ID 1775172