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Benzenesulfonamide, 4-methyl-N-[4-[[(4-methylphenyl)sulfonyl]amino]butyl]-N-[3-(2-oxoazac ycloheptadec-1-yl)propyl]-
SpectraBase Compound ID IX8YscHGT9V
InChI InChI=1S/C37H59N3O5S2/c1-33-20-24-35(25-21-33)46(42,43)38-28-15-17-31-40(47(44,45)36-26-22-34(2)23-27-36)32-18-30-39-29-16-13-11-9-7-5-3-4-6-8-10-12-14-19-37(39)41/h20-27,38H,3-19,28-32H2,1-2H3
InChIKey UYXGCMDDXRIXGP-UHFFFAOYSA-N
Mol Weight 690.0 g/mol
Molecular Formula C37H59N3O5S2
Exact Mass 689.389614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HA8kBtfS3FU
Name Benzenesulfonamide, 4-methyl-N-[4-[[(4-methylphenyl)sulfonyl]amino]butyl]-N-[3-(2-oxoazac ycloheptadec-1-yl)propyl]-
Alternate Name(s) 4-Methyl-N-(4-{[(4-methylphenyl)sulfonyl]amino}butyl)-N-[3-(2-oxoazacycloheptadecan-1-yl)propyl]benzenesulfonamide Azacycloheptadecane, benzenesulfonamide deriv. N-[4-tosyl-8-(tosylamino)-4-azaoctyl]-16-hexadecanlactam
CAS Registry Number 91652-54-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C37H59N3O5S2
InChI InChI=1S/C37H59N3O5S2/c1-33-20-24-35(25-21-33)46(42,43)38-28-15-17-31-40(47(44,45)36-26-22-34(2)23-27-36)32-18-30-39-29-16-13-11-9-7-5-3-4-6-8-10-12-14-19-37(39)41/h20-27,38H,3-19,28-32H2,1-2H3
InChIKey UYXGCMDDXRIXGP-UHFFFAOYSA-N
Molecular Weight 690.015 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)CCCCN(S(c1ccc(cc1)C)(=O)=O)CCCN1C(=O)CCCCCCCCCCCCCCC1
SPLASH splash10-0a4i-9141100000-f546c4c6c8c6934b8882
Source of Spectrum H-67-2182-0
Wiley ID 1414643