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(R)-4-Cyclopentylsulfanyl-heptan-2-one
SpectraBase Compound ID 57vXBbmY6GP
InChI InChI=1S/C12H22OS/c1-3-6-12(9-10(2)13)14-11-7-4-5-8-11/h11-12H,3-9H2,1-2H3/t12-/m1/s1
InChIKey CZQFFPUYASJRCD-GFCCVEGCSA-N
Mol Weight 214.37 g/mol
Molecular Formula C12H22OS
Exact Mass 214.139137 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ELEtqKs2LlW
Name (R)-4-Cyclopentylsulfanyl-heptan-2-one
Alternate Name(s) (R)-4-(cyclopentylthio)heptan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22OS
InChI InChI=1S/C12H22OS/c1-3-6-12(9-10(2)13)14-11-7-4-5-8-11/h11-12H,3-9H2,1-2H3/t12-/m1/s1
InChIKey CZQFFPUYASJRCD-GFCCVEGCSA-N
Literature Reference DOI 10.1021/ol200379r
Molecular Weight 214.367 g/mol
SMILES C([C@](CC(C)=O)(SC1CCCC1)[H])CC
SPLASH splash10-0f6x-9310000000-7cd70fab3d6145df35b0
Source of Spectrum A1-13-2150/SMS9-18
Wiley ID 1753117