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2-Butanone, 3-methyl-1-phenyl-1,3-bis(phenylthio)-
SpectraBase Compound ID A1O9ut1JgEl
InChI InChI=1S/C23H22OS2/c1-23(2,26-20-16-10-5-11-17-20)22(24)21(18-12-6-3-7-13-18)25-19-14-8-4-9-15-19/h3-17,21H,1-2H3
InChIKey OOTJBRAKEFDLTN-UHFFFAOYSA-N
Mol Weight 378.55 g/mol
Molecular Formula C23H22OS2
Exact Mass 378.111208 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ku9B0EomvWy
Name 2-Butanone, 3-methyl-1-phenyl-1,3-bis(phenylthio)-
Alternate Name(s) 3-Methyl-1-phenyl-1,3-bis(phenylsulfanyl)-2-butanone 3-Methyl-1-phenyl-1,3-bis(phenylthio)-2-butanone
CAS Registry Number 104354-57-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H22OS2
InChI InChI=1S/C23H22OS2/c1-23(2,26-20-16-10-5-11-17-20)22(24)21(18-12-6-3-7-13-18)25-19-14-8-4-9-15-19/h3-17,21H,1-2H3
InChIKey OOTJBRAKEFDLTN-UHFFFAOYSA-N
Molecular Weight 378.548 g/mol
SMILES C(C(Sc1ccccc1)(C)C)(C(Sc1ccccc1)c1ccccc1)=O
SPLASH splash10-0udi-0900000000-031533eda4339e4398f6
Source of Spectrum AJ-58-2853-9
Wiley ID 1358911