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Benzenamine, 4-methoxy-N,N-bis[4-[(4-methylphenyl)sulfonyl]-2-butynyl]-
SpectraBase Compound ID BVPa9JA5uEI
InChI InChI=1S/C29H29NO5S2/c1-24-8-16-28(17-9-24)36(31,32)22-6-4-20-30(26-12-14-27(35-3)15-13-26)21-5-7-23-37(33,34)29-18-10-25(2)11-19-29/h8-19H,20-23H2,1-3H3
InChIKey WUQVQFDNIMHAJM-UHFFFAOYSA-N
Mol Weight 535.67 g/mol
Molecular Formula C29H29NO5S2
Exact Mass 535.148715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G3oT36yQgL4
Name Benzenamine, 4-methoxy-N,N-bis[4-[(4-methylphenyl)sulfonyl]-2-butynyl]-
CAS Registry Number 75931-76-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H29NO5S2
InChI InChI=1S/C29H29NO5S2/c1-24-8-16-28(17-9-24)36(31,32)22-6-4-20-30(26-12-14-27(35-3)15-13-26)21-5-7-23-37(33,34)29-18-10-25(2)11-19-29/h8-19H,20-23H2,1-3H3
InChIKey WUQVQFDNIMHAJM-UHFFFAOYSA-N
Molecular Weight 535.673 g/mol
SMILES c1(S(=O)(=O)CC#CCN(c2ccc(cc2)OC)CC#CCS(c2ccc(cc2)C)(=O)=O)ccc(cc1)C
SPLASH splash10-00dr-0901000000-06e465fab029f6922c2a
Source of Spectrum O-15-25-2
Synonyms 4-Methoxy-N,N-bis{4-[(4-methylphenyl)sulfonyl]-2-butynyl}aniline N,N-bis(4'-tosyl-2'-butynyl)-4-anisidine N-(4-methoxyphenyl)-N,N-bis{4-[(4-methylphenyl)sulfonyl]-2-butynyl}amine
Wiley ID 1403946