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1-benzyloxy-3-phenylthiopropene
SpectraBase Compound ID 318uLpW4Dnq
InChI InChI=1S/C16H16OS/c1-3-8-15(9-4-1)14-17-12-7-13-18-16-10-5-2-6-11-16/h1-12H,13-14H2/b12-7+
InChIKey XYXOBQZBAKXLDD-KPKJPENVSA-N
Mol Weight 256.36 g/mol
Molecular Formula C16H16OS
Exact Mass 256.092186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KwZBvLZXv6s
Name 1-benzyloxy-3-phenylthiopropene
Alternate Name(s) benzyl (1E)-3-(phenylsulfanyl)-1-propenyl ether {[(2E)-3-(benzyloxy)-2-propenyl]sulfanyl}benzene
CAS Registry Number 124571-30-8
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16OS
InChI InChI=1S/C16H16OS/c1-3-8-15(9-4-1)14-17-12-7-13-18-16-10-5-2-6-11-16/h1-12H,13-14H2/b12-7+
InChIKey XYXOBQZBAKXLDD-KPKJPENVSA-N
Molecular Weight 256.363 g/mol
SMILES C(O\C=C\CSc1ccccc1)c1ccccc1
SPLASH splash10-0002-0910000000-a40fd357f74b72bbae18
Source of Spectrum F-45-2976-16
Wiley ID 1260003