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3,3-bis(phenylthio)butanoic acid ethyl ester
SpectraBase Compound ID Ehelph6YcgH
InChI InChI=1S/C18H20O2S2/c1-3-20-17(19)14-18(2,21-15-10-6-4-7-11-15)22-16-12-8-5-9-13-16/h4-13H,3,14H2,1-2H3
InChIKey VGDFSFHAJKIZOP-UHFFFAOYSA-N
Mol Weight 332.48 g/mol
Molecular Formula C18H20O2S2
Exact Mass 332.090472 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G9Ru93ravMe
Name 3,3-bis(phenylthio)butanoic acid ethyl ester
CAS Registry Number 64206-12-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O2S2
InChI InChI=1S/C18H20O2S2/c1-3-20-17(19)14-18(2,21-15-10-6-4-7-11-15)22-16-12-8-5-9-13-16/h4-13H,3,14H2,1-2H3
InChIKey VGDFSFHAJKIZOP-UHFFFAOYSA-N
Molecular Weight 332.476 g/mol
SMILES C(CC(=O)OCC)(Sc1ccccc1)(Sc1ccccc1)C
SPLASH splash10-024j-0920000000-39fe9bed389080b6d269
Source of Spectrum F-43-2480-1
Synonyms 3,3-bis(phenylthio)butyric acid ethyl ester Ethyl 3,3-bis(phenylsulfanyl)butanoate
Wiley ID 1329317