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Cyclopentanone, 3-[1-(phenylsulfinyl)-2-propenyl]-, [3R*(1R*)]-
SpectraBase Compound ID FCzHb43XYBA
InChI InChI=1S/C14H16O2S/c1-2-14(11-8-9-12(15)10-11)17(16)13-6-4-3-5-7-13/h2-7,11,14H,1,8-10H2
InChIKey DYLLNUXWEHHETE-UHFFFAOYSA-N
Mol Weight 248.34 g/mol
Molecular Formula C14H16O2S
Exact Mass 248.087101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gi5Z3SzXJFe
Name Cyclopentanone, 3-[1-(phenylsulfinyl)-2-propenyl]-, [3R*(1R*)]-
Alternate Name(s) 3-[1'-(phenylsulfinyl)prop-2'-enyl]-cyclopentan-1-one 3-[1-(phenylsulfinyl)-2-propenyl]cyclopentanone
CAS Registry Number 80795-72-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O2S
InChI InChI=1S/C14H16O2S/c1-2-14(11-8-9-12(15)10-11)17(16)13-6-4-3-5-7-13/h2-7,11,14H,1,8-10H2
InChIKey DYLLNUXWEHHETE-UHFFFAOYSA-N
Molecular Weight 248.340 g/mol
SMILES C(S(=O)c1ccccc1)(C1CC(=O)CC1)C=C
SPLASH splash10-00vj-9500000000-d842f578750bb69ab0bd
Source of Spectrum B-34-2467-0
Wiley ID 1251008