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Benzenamine, N-[4-[(4-chlorophenyl)sulfonyl]-2-butynyl]-N-[4-[(4-chlorophenyl)thio]-2-butynyl]-4-methyl-
SpectraBase Compound ID B3JlzqnCjwv
InChI InChI=1S/C27H23Cl2NO2S2/c1-22-6-12-25(13-7-22)30(18-2-4-20-33-26-14-8-23(28)9-15-26)19-3-5-21-34(31,32)27-16-10-24(29)11-17-27/h6-17H,18-21H2,1H3
InChIKey FMHWCWKPTVYAMV-UHFFFAOYSA-N
Mol Weight 528.51 g/mol
Molecular Formula C27H23Cl2NO2S2
Exact Mass 527.054727 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A97mSpWdC9D
Name Benzenamine, N-[4-[(4-chlorophenyl)sulfonyl]-2-butynyl]-N-[4-[(4-chlorophenyl)thio]-2-butynyl]-4-methyl-
CAS Registry Number 97479-54-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H23Cl2NO2S2
InChI InChI=1S/C27H23Cl2NO2S2/c1-22-6-12-25(13-7-22)30(18-2-4-20-33-26-14-8-23(28)9-15-26)19-3-5-21-34(31,32)27-16-10-24(29)11-17-27/h6-17H,18-21H2,1H3
InChIKey FMHWCWKPTVYAMV-UHFFFAOYSA-N
Molecular Weight 528.512 g/mol
SMILES c1(S(=O)(=O)CC#CCN(c2ccc(cc2)C)CC#CCSc2ccc(cc2)Cl)ccc(cc1)Cl
SPLASH splash10-0a4i-1921000000-6b5ea305ec4717657bd0
Source of Spectrum O-20-284-5
Synonyms N-(4'-(4-chlorophenyl)sulphonyl-2'-butynyl)-N-(4''-(4-chlorophenyl)thio-2''-butynyl)-para-toluidine N-(4'-(4-chlorophenyl)sulphonyl-2'-butynyl)-N-(4''-(4-chlorophenyl)thio-2''-butynyl)-para-toluidine N-{4-[(4-chlorophenyl)sulfanyl]-2-butynyl}-N-{4-[(4-chlorophenyl)sulfonyl]-2-butynyl}-4-methylaniline N-{4-[(4-chlorophenyl)sulfanyl]-2-butynyl}-N-{4-[(4-chlorophenyl)sulfonyl]-2-butynyl}-N-(4-methylphenyl)amine
Wiley ID 1402952