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(3aR,4R,6aS)-4-(phenylsulfanylmethyl)-3,3a,4,6a-tetrahydrocyclopenta[b]furan-2-one
SpectraBase Compound ID Eea5Xhqddxu
InChI InChI=1S/C14H14O2S/c15-14-8-12-10(6-7-13(12)16-14)9-17-11-4-2-1-3-5-11/h1-7,10,12-13H,8-9H2/t10-,12+,13-/m0/s1
InChIKey VPCYGKBASOUCKJ-UHTWSYAYSA-N
Mol Weight 246.32 g/mol
Molecular Formula C14H14O2S
Exact Mass 246.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 73j8LKyMIuJ
Name (3aR,4R,6aS)-4-(phenylsulfanylmethyl)-3,3a,4,6a-tetrahydrocyclopenta[b]furan-2-one
Alternate Name(s) (3aR,4R,6aS)-4-[(phenylthio)methyl]-3,3a,4,6a-tetrahydrocyclopenta[b]furan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14O2S
InChI InChI=1S/C14H14O2S/c15-14-8-12-10(6-7-13(12)16-14)9-17-11-4-2-1-3-5-11/h1-7,10,12-13H,8-9H2/t10-,12+,13-/m0/s1
InChIKey VPCYGKBASOUCKJ-UHTWSYAYSA-N
Molecular Weight 246.324 g/mol
SMILES [C@@]12(OC(C[C@@]2([C@](CSc2ccccc2)(C=C1)[H])[H])=O)[H]
SPLASH splash10-00dj-7920000000-5427528dcc4356f2550e
Source of Spectrum F-68-6007-5
Wiley ID 1573038