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1-(2-Methylsulfanylbenzoyl)propylidene(triphenyl)phosphorane
SpectraBase Compound ID K56PdRbngA6
InChI InChI=1S/C29H27OPS/c1-3-27(29(30)26-21-13-14-22-28(26)32-2)31(23-15-7-4-8-16-23,24-17-9-5-10-18-24)25-19-11-6-12-20-25/h4-22H,3H2,1-2H3
InChIKey WNICKOUMJAKEHR-UHFFFAOYSA-N
Mol Weight 454.57 g/mol
Molecular Formula C29H27OPS
Exact Mass 454.152024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H2hSvnBjiS3
Name 1-(2-Methylsulfanylbenzoyl)propylidene(triphenyl)phosphorane
Alternate Name(s) 1-[2-(methylsulfanyl)phenyl]-2-(triphenylphosphoranylidene)-1-butanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H27OPS
InChI InChI=1S/C29H27OPS/c1-3-27(29(30)26-21-13-14-22-28(26)32-2)31(23-15-7-4-8-16-23,24-17-9-5-10-18-24)25-19-11-6-12-20-25/h4-22H,3H2,1-2H3
InChIKey WNICKOUMJAKEHR-UHFFFAOYSA-N
Molecular Weight 454.568 g/mol
SMILES C(=P(c1ccccc1)(c1ccccc1)c1ccccc1)(C(c1c(SC)cccc1)=O)CC
SPLASH splash10-03di-0890700000-d140133797b1d8158956
Source of Spectrum KC-0-2458-4
Wiley ID 782082