For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-benzoyl-5-(p-anisylthio)-3-phenyl-benzoic acid methyl ester
SpectraBase Compound ID Blw5D7d0ox4
InChI InChI=1S/C29H24O4S/c1-32-23-15-13-20(14-16-23)19-34-24-17-25(21-9-5-3-6-10-21)27(26(18-24)29(31)33-2)28(30)22-11-7-4-8-12-22/h3-18H,19H2,1-2H3
InChIKey QPKMDBALKWBLDS-UHFFFAOYSA-N
Mol Weight 468.57 g/mol
Molecular Formula C29H24O4S
Exact Mass 468.13953 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 8KMBuEXohLP
Name 2-benzoyl-5-(p-anisylthio)-3-phenyl-benzoic acid methyl ester
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H24O4S
InChI InChI=1S/C29H24O4S/c1-32-23-15-13-20(14-16-23)19-34-24-17-25(21-9-5-3-6-10-21)27(26(18-24)29(31)33-2)28(30)22-11-7-4-8-12-22/h3-18H,19H2,1-2H3
InChIKey QPKMDBALKWBLDS-UHFFFAOYSA-N
Molecular Weight 468.567 g/mol
SMILES c1(c(c(cc(c1)SCc1ccc(cc1)OC)C(=O)OC)C(c1ccccc1)=O)-c1ccccc1
SPLASH splash10-00di-0900100000-50d59e2b066b7ae93f95
Source of Spectrum J-64-6186-10
Synonyms 2-benzoyl-5-[(4-methoxyphenyl)methylthio]-3-phenylbenzoic acid methyl ester methyl 2-benzoyl-5-[(4-methoxyphenyl)methylsulfanyl]-3-phenyl-benzoate methyl 5-[(4-methoxyphenyl)methylsulfanyl]-3-phenyl-2-(phenylcarbonyl)benzoate
Wiley ID 1530786