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Cyclopropanemethanol, .alpha.-(phenylthio)-, benzoate
SpectraBase Compound ID BprNWV59V90
InChI InChI=1S/C17H16O2S/c18-16(13-7-3-1-4-8-13)19-17(14-11-12-14)20-15-9-5-2-6-10-15/h1-10,14,17H,11-12H2
InChIKey OHUJJRCOFNFHEC-UHFFFAOYSA-N
Mol Weight 284.37 g/mol
Molecular Formula C17H16O2S
Exact Mass 284.087101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3SqFuW8yJcY
Name Cyclopropanemethanol, .alpha.-(phenylthio)-, benzoate
Alternate Name(s) 1-(Phenylthio)-1-(cyclopropyl)methyl benzoate cyclopropyl(phenylsulfanyl)methyl benzoate
CAS Registry Number 131758-64-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16O2S
InChI InChI=1S/C17H16O2S/c18-16(13-7-3-1-4-8-13)19-17(14-11-12-14)20-15-9-5-2-6-10-15/h1-10,14,17H,11-12H2
InChIKey OHUJJRCOFNFHEC-UHFFFAOYSA-N
Molecular Weight 284.373 g/mol
SMILES C(OC(=O)c1ccccc1)(C1CC1)Sc1ccccc1
SPLASH splash10-0a4i-5900000000-076da250dcc724fa48bb
Source of Spectrum C-113-1735-3
Wiley ID 1288025