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N,N-bis[4-(p-tolylthio)-2-butynyl]-p-toluidine
SpectraBase Compound ID Crk039g1XC4
InChI InChI=1S/C29H29NS2/c1-24-8-14-27(15-9-24)30(20-4-6-22-31-28-16-10-25(2)11-17-28)21-5-7-23-32-29-18-12-26(3)13-19-29/h8-19H,20-23H2,1-3H3
InChIKey HEWUTAIWSQKZPJ-UHFFFAOYSA-N
Mol Weight 455.68 g/mol
Molecular Formula C29H29NS2
Exact Mass 455.174142 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID w16inDGsoI
Name Benzenamine, 4-methyl-N,N-bis[4-[(4-methylphenyl)thio]-2-butynyl]-
Alternate Name(s) 4-Methyl-N,N-bis{4-[(4-methylphenyl)sulfanyl]-2-butynyl}aniline N,N-bis(4'-p-tolylthio-2'-butynyl)-4-methylaniline N,N-bis(4'-p-tolylthio-2-butynyl)-p-toludine N-(4-methylphenyl)-N,N-bis{4-[(4-methylphenyl)sulfanyl]-2-butynyl}amine
CAS Registry Number 75931-67-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H29NS2
InChI InChI=1S/C29H29NS2/c1-24-8-14-27(15-9-24)30(20-4-6-22-31-28-16-10-25(2)11-17-28)21-5-7-23-32-29-18-12-26(3)13-19-29/h8-19H,20-23H2,1-3H3
InChIKey HEWUTAIWSQKZPJ-UHFFFAOYSA-N
Molecular Weight 455.678 g/mol
SMILES C(#CCSc1ccc(cc1)C)CN(c1ccc(cc1)C)CC#CCSc1ccc(cc1)C
SPLASH splash10-0a4i-5910000000-a1f68459b58705c90f83
Source of Spectrum O-15-25-1
Wiley ID 1389077