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4,5-Dihydro-5-methyl-2H-thiophen-3-one

View entire compound with spectra: 2 MS (GC)

4,5-Dihydro-5-methyl-2H-thiophen-3-one
SpectraBase Compound ID 6JyDnB5TbGu
InChI InChI=1S/C5H8OS/c1-4-2-5(6)3-7-4/h4H,2-3H2,1H3
InChIKey GYAWKNURSWKRNU-UHFFFAOYSA-N
Mol Weight 116.18 g/mol
Molecular Formula C5H8OS
Exact Mass 116.029586 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B5JGBzmLTm7
Name 4,5-Dihydro-5-methyl-2H-thiophen-3-one
Classification Thiolanes
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 116.029586051 u
Formula C5H8OS
InChI InChI=1S/C5H8OS/c1-4-2-5(6)3-7-4/h4H,2-3H2,1H3
InChIKey GYAWKNURSWKRNU-UHFFFAOYSA-N
Molecular Weight 116.178 g/mol
Number of Peaks 16
SMILES C1SC(CC1=O)C
SPLASH splash10-01b9-7900000000-398f409614cb9753782e
Source of Spectrum FF-13-181-13 (DOI: 10.1002_(SICI)1099-1026(199805_06)13_3_177)
Synonyms 5-Methyldihydrothiophen-3(2H)-one 5-Methyl-3-thiolanone 5-Methylthiolan-3-one
Wiley ID 1775165