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3-(Methylsulfanyl)-3-(1-phenylpropyl)tetrahydrofuran-2-one isomer
SpectraBase Compound ID 7OFbHgdb3yV
InChI InChI=1S/C14H18O2S/c1-3-12(11-7-5-4-6-8-11)14(17-2)9-10-16-13(14)15/h4-8,12H,3,9-10H2,1-2H3
InChIKey UIZPZYXWCVHGCO-UHFFFAOYSA-N
Mol Weight 250.36 g/mol
Molecular Formula C14H18O2S
Exact Mass 250.102751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dn8WwSeesru
Name 3-(Methylsulfanyl)-3-(1-phenylpropyl)tetrahydrofuran-2-one isomer
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O2S
InChI InChI=1S/C14H18O2S/c1-3-12(11-7-5-4-6-8-11)14(17-2)9-10-16-13(14)15/h4-8,12H,3,9-10H2,1-2H3
InChIKey UIZPZYXWCVHGCO-UHFFFAOYSA-N
Molecular Weight 250.356 g/mol
SMILES C1(C(OCC1)=O)(C(c1ccccc1)CC)SC
SPLASH splash10-0006-9400000000-2400a65e4dde8fc52ee8
Source of Spectrum KC-0-1840-9
Synonyms 3-(methylsulfanyl)-3-(1-phenylpropyl)dihydro-2(3H)-furanone
Wiley ID 781541