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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 4FFmA70ooxV
Name 4,5-Dihydro-5-methyl-2H-thiophen-3-one
Alternate Name(s) 5-Methyldihydrothiophen-3(2H)-one 5-Methyl-3-thiolanone 5-Methylthiolan-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H8OS
InChI InChI=1S/C5H8OS/c1-4-2-5(6)3-7-4/h4H,2-3H2,1H3
InChIKey GYAWKNURSWKRNU-UHFFFAOYSA-N
Literature Reference DOI 10.1002_(SICI)1099-1026(199805_06)13_3_177
Molecular Weight 116.178 g/mol
SMILES C1SC(CC1=O)C
SPLASH splash10-01b9-7900000000-398f409614cb9753782e
Source of Spectrum FF-13-181-13
Wiley ID 1775165