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Benzenamine, N-[4-[(4-chlorophenyl)sulfonyl]-2-butynyl]-N-[4-[(4-chlorophenyl)thio]-2-butynyl]-4-methoxy-
SpectraBase Compound ID 9g3OmKFJjXK
InChI InChI=1S/C27H23Cl2NO3S2/c1-33-25-12-10-24(11-13-25)30(18-2-4-20-34-26-14-6-22(28)7-15-26)19-3-5-21-35(31,32)27-16-8-23(29)9-17-27/h6-17H,18-21H2,1H3
InChIKey JAPGYNAHWPJEMY-UHFFFAOYSA-N
Mol Weight 544.51 g/mol
Molecular Formula C27H23Cl2NO3S2
Exact Mass 543.049641 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DA68pXEIsBG
Name Benzenamine, N-[4-[(4-chlorophenyl)sulfonyl]-2-butynyl]-N-[4-[(4-chlorophenyl)thio]-2-butynyl]-4-methoxy-
Alternate Name(s) N-(4'-(4-chlorophenyl)sulphonyl-2'-butynyl)-N-(4''-(4-chlorophenyl)thio-2''-butynyl)-para-anisidine N-(4'-(4-chlorophenyl)sulphonyl-2'-butynyl)-N-(4''-(4-chlorophenyl)thio-2''-butynyl)-para-anisidine N-{4-[(4-chlorophenyl)sulfanyl]-2-butynyl}-N-{4-[(4-chlorophenyl)sulfonyl]-2-butynyl}-4-methoxyaniline N-{4-[(4-chlorophenyl)sulfanyl]-2-butynyl}-N-{4-[(4-chlorophenyl)sulfonyl]-2-butynyl}-N-(4-methoxyphenyl)amine
CAS Registry Number 97479-56-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H23Cl2NO3S2
InChI InChI=1S/C27H23Cl2NO3S2/c1-33-25-12-10-24(11-13-25)30(18-2-4-20-34-26-14-6-22(28)7-15-26)19-3-5-21-35(31,32)27-16-8-23(29)9-17-27/h6-17H,18-21H2,1H3
InChIKey JAPGYNAHWPJEMY-UHFFFAOYSA-N
Molecular Weight 544.511 g/mol
SMILES c1(S(=O)(=O)CC#CCN(c2ccc(cc2)OC)CC#CCSc2ccc(cc2)Cl)ccc(cc1)Cl
SPLASH splash10-00xr-2911000000-09e6b2d0c00f0aa5e49e
Source of Spectrum O-20-284-5
Wiley ID 1404936