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2(3H)-Furanone, dihydro-5-[1-(phenylthio)propylidene]-, (E)-
SpectraBase Compound ID C5Nt3eQbIz0
InChI InChI=1S/C13H14O2S/c1-2-12(11-8-9-13(14)15-11)16-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3/b12-11+
InChIKey KFVLBCWUBLLMMD-VAWYXSNFSA-N
Mol Weight 234.31 g/mol
Molecular Formula C13H14O2S
Exact Mass 234.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CFgzgeh3LRV
Name 2(3H)-Furanone, dihydro-5-[1-(phenylthio)propylidene]-, (E)-
Alternate Name(s) (5E)-5-[1-(phenylsulfanyl)propylidene]dihydro-2(3H)-furanone (E)-4-(1-phenylthiopropylidene)butan-4-olide
CAS Registry Number 109573-95-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O2S
InChI InChI=1S/C13H14O2S/c1-2-12(11-8-9-13(14)15-11)16-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3/b12-11+
InChIKey KFVLBCWUBLLMMD-VAWYXSNFSA-N
Molecular Weight 234.313 g/mol
SMILES C1(O\C(CC1)=C\(Sc1ccccc1)CC)=O
SPLASH splash10-001i-0190000000-6fc84c8eb86f7a55f1c9
Source of Spectrum KC-1986-2001-2
Wiley ID 1235847