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Ethyl 2-{[o-(Benzhydryloxy)carbonylmethyl]phenyl}-2-(phenylthio)acetate
SpectraBase Compound ID E8zG09d2XPb
InChI InChI=1S/C31H28O4S/c1-2-34-31(33)30(36-26-19-10-5-11-20-26)27-21-13-12-18-25(27)22-28(32)35-29(23-14-6-3-7-15-23)24-16-8-4-9-17-24/h3-21,29-30H,2,22H2,1H3
InChIKey FKNHLWBBQOTUCP-UHFFFAOYSA-N
Mol Weight 496.62 g/mol
Molecular Formula C31H28O4S
Exact Mass 496.170831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FvwH2HZIuRD
Name Ethyl 2-{[o-(Benzhydryloxy)carbonylmethyl]phenyl}-2-(phenylthio)acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H28O4S
InChI InChI=1S/C31H28O4S/c1-2-34-31(33)30(36-26-19-10-5-11-20-26)27-21-13-12-18-25(27)22-28(32)35-29(23-14-6-3-7-15-23)24-16-8-4-9-17-24/h3-21,29-30H,2,22H2,1H3
InChIKey FKNHLWBBQOTUCP-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol703058p
Molecular Weight 496.621 g/mol
SMILES c1cc(c(C(Sc2ccccc2)C(=O)OCC)cc1)CC(OC(c1ccccc1)c1ccccc1)=O
SPLASH splash10-014i-2931000000-86e48241f798a971b1ad
Source of Spectrum A1-10-693/SMS5-5l
Synonyms Ethyl 2-(2-(2-(benzhydryloxy)-2-oxoethyl)phenyl)-2-(phenylthio)acetate
Wiley ID 1759159