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Benzenepropanethioamide, 4-methyl-N-phenyl-.alpha.,.beta.-bis(phenylimino)-
SpectraBase Compound ID 8rwNHSya5BQ
InChI InChI=1S/C28H23N3S/c1-21-17-19-22(20-18-21)26(29-23-11-5-2-6-12-23)27(30-24-13-7-3-8-14-24)28(32)31-25-15-9-4-10-16-25/h2-20H,1H3,(H,31,32)/b29-26+,30-27-
InChIKey GYLJKPRAPQIJQV-VIULMGQOSA-N
Mol Weight 433.57 g/mol
Molecular Formula C28H23N3S
Exact Mass 433.161269 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9zFFnJQTGoM
Name Benzenepropanethioamide, 4-methyl-N-phenyl-.alpha.,.beta.-bis(phenylimino)-
Alternate Name(s) (2Z,3E)-3-(4-methylphenyl)-N-phenyl-2,3-bis(phenylimino)propanethioamide 3-Anilinothiocarbonyl-1,4-diphenyl-2-p-tolyl-1,4-diazabutadiene
CAS Registry Number 80858-24-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H23N3S
InChI InChI=1S/C28H23N3S/c1-21-17-19-22(20-18-21)26(29-23-11-5-2-6-12-23)27(30-24-13-7-3-8-14-24)28(32)31-25-15-9-4-10-16-25/h2-20H,1H3,(H,31,32)/b29-26+,30-27-
InChIKey GYLJKPRAPQIJQV-VIULMGQOSA-N
Molecular Weight 433.573 g/mol
SMILES N(C(\C(\C(=N\c1ccccc1)c1ccc(cc1)C)=N/c1ccccc1)=S)c1ccccc1
SPLASH splash10-0006-0901100000-a124b8923515f969dc3d
Source of Spectrum AH-112-1411-0
Wiley ID 1382745