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3-Cyclohexenyl-3-(phenylsulfanyl)propyl benzoate
SpectraBase Compound ID LaOUHfaXxQv
InChI InChI=1S/C22H24O2S/c23-22(19-12-6-2-7-13-19)24-17-16-21(18-10-4-1-5-11-18)25-20-14-8-3-9-15-20/h2-3,6-10,12-15,21H,1,4-5,11,16-17H2
InChIKey MXQLMERTJDISLE-UHFFFAOYSA-N
Mol Weight 352.49 g/mol
Molecular Formula C22H24O2S
Exact Mass 352.149701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D0azCJoFeGa
Name 3-Cyclohexenyl-3-(phenylsulfanyl)propyl benzoate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24O2S
InChI InChI=1S/C22H24O2S/c23-22(19-12-6-2-7-13-19)24-17-16-21(18-10-4-1-5-11-18)25-20-14-8-3-9-15-20/h2-3,6-10,12-15,21H,1,4-5,11,16-17H2
InChIKey MXQLMERTJDISLE-UHFFFAOYSA-N
Molecular Weight 352.492 g/mol
SMILES C(=O)(c1ccccc1)OCCC(C1=CCCCC1)Sc1ccccc1
SPLASH splash10-05fu-0931000000-9ff120f78d07f9008f3d
Source of Spectrum KC-0-2778-32
Synonyms 3-(1-cyclohexen-1-yl)-3-(phenylsulfanyl)propyl benzoate 3-Cyclohexenyl-3-(phenylsulfayl)propyl benzoate benzoic acid[3-(1-cyclohexenyl)-3-(phenylthio)propyl]ester benzoic acid[3-(cyclohexen-1-yl)-3-(phenylthio)propyl]ester [3-(cyclohexen-1-yl)-3-phenylsulfanyl-propyl]benzoate benzoic acid [3-(1-cyclohexenyl)-3-(phenylthio)propyl] ester [3-(cyclohexen-1-yl)-3-phenylsulfanylpropyl] benzoate [3-(cyclohexen-1-yl)-3-phenylsulfanyl-propyl] benzoate
Wiley ID 829098