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Benzenamine, N-[4-[(4-chlorophenyl)sulfonyl]-2-butynyl]-4-methyl-N-[4-[(4-methylphenyl)thio]-2-butynyl]-
SpectraBase Compound ID 8wFPXulRoeL
InChI InChI=1S/C28H26ClNO2S2/c1-23-7-13-26(14-8-23)30(19-3-5-21-33-27-15-9-24(2)10-16-27)20-4-6-22-34(31,32)28-17-11-25(29)12-18-28/h7-18H,19-22H2,1-2H3
InChIKey BPEKINAASLFGOP-UHFFFAOYSA-N
Mol Weight 508.09 g/mol
Molecular Formula C28H26ClNO2S2
Exact Mass 507.109349 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID nfHee28EOR
Name Benzenamine, N-[4-[(4-chlorophenyl)sulfonyl]-2-butynyl]-4-methyl-N-[4-[(4-methylphenyl)thio]-2-butynyl]-
CAS Registry Number 97479-53-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H26ClNO2S2
InChI InChI=1S/C28H26ClNO2S2/c1-23-7-13-26(14-8-23)30(19-3-5-21-33-27-15-9-24(2)10-16-27)20-4-6-22-34(31,32)28-17-11-25(29)12-18-28/h7-18H,19-22H2,1-2H3
InChIKey BPEKINAASLFGOP-UHFFFAOYSA-N
Molecular Weight 508.094 g/mol
SMILES c1(S(=O)(=O)CC#CCN(c2ccc(cc2)C)CC#CCSc2ccc(cc2)C)ccc(cc1)Cl
SPLASH splash10-0a4i-1951010000-c0fd128d070146d138f8
Source of Spectrum O-20-284-5
Synonyms N-(4'-(4-chlorophenyl)sulphonyl-2'-butynyl)-N-(4''-para-tolylthio-2''-butynyl)-para-toluidine N-(4'-(4-chlorophenyl)sulphonyl-2'-butynyl)-N-(4''-para-tolylthio-2''-butynyl)-para-toluidine N-{4-[(4-chlorophenyl)sulfonyl]-2-butynyl}-4-methyl-N-{4-[(4-methylphenyl)sulfanyl]-2-butynyl}aniline N-{4-[(4-chlorophenyl)sulfonyl]-2-butynyl}-N-(4-methylphenyl)-N-{4-[(4-methylphenyl)sulfanyl]-2-butynyl}amine
Wiley ID 1400026