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3-Methyl-4-(phenylthio)-5H-furan-2-one

View entire compound with spectra: 3 MS (GC)

3-Methyl-4-(phenylthio)-5H-furan-2-one
SpectraBase Compound ID 3Qd3jT9IpRv
InChI InChI=1S/C11H10O2S/c1-8-10(7-13-11(8)12)14-9-5-3-2-4-6-9/h2-6H,7H2,1H3
InChIKey MQTYMDQKEIWOJZ-UHFFFAOYSA-N
Mol Weight 206.26 g/mol
Molecular Formula C11H10O2S
Exact Mass 206.040151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LuXx80Y8dB3
Name 3-Methyl-4-(phenylthio)-5H-furan-2-one
Alternate Name(s) 3-Methyl-4-(phenylsulfanyl)-2(5H)-furanone 4-Methyl-3-(phenylthio)-2H-furan-5-one 4-Methyl-3-phenylsulfanyl-2H-furan-5-one
CAS Registry Number 117621-13-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H10O2S
InChI InChI=1S/C11H10O2S/c1-8-10(7-13-11(8)12)14-9-5-3-2-4-6-9/h2-6H,7H2,1H3
InChIKey MQTYMDQKEIWOJZ-UHFFFAOYSA-N
Molecular Weight 206.259 g/mol
SMILES C1(=C(Sc2ccccc2)COC1=O)C
SPLASH splash10-0a4j-9420000000-9e443fc7507ae0368d10
Wiley ID 1474550