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2(3H)-Furanone, dihydro-4-(1-methylethyl)-4-(phenylthio)-
SpectraBase Compound ID Fx2bOBh4hJ5
InChI InChI=1S/C13H16O2S/c1-10(2)13(8-12(14)15-9-13)16-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3
InChIKey LZPMBVSNAVXGBL-UHFFFAOYSA-N
Mol Weight 236.33 g/mol
Molecular Formula C13H16O2S
Exact Mass 236.087101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EeeLgc7qgdp
Name 2(3H)-Furanone, dihydro-4-(1-methylethyl)-4-(phenylthio)-
CAS Registry Number 79749-93-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O2S
InChI InChI=1S/C13H16O2S/c1-10(2)13(8-12(14)15-9-13)16-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3
InChIKey LZPMBVSNAVXGBL-UHFFFAOYSA-N
Molecular Weight 236.329 g/mol
SMILES C1(CC(=O)OC1)(Sc1ccccc1)C(C)C
SPLASH splash10-03di-0920000000-4ad54db4adc2cfed8056
Source of Spectrum KC-1981-2757-0
Synonyms 4-isopropyl-4-(phenylsulfanyl)dihydro-2(3H)-furanone 4-Isopropyl-4-(phenylthio)-4,5-dihydrofuran-2(3H)-one
Wiley ID 1237963