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Benzoic acid, 5-[[4-(hexyloxy)phenyl]amino]-2-[[[2,4,6-tris(1-methylethyl)phenyl]sulfonyl]amino]-, ethyl ester
SpectraBase Compound ID CyQFlVGiQLZ
InChI InChI=1S/C36H50N2O5S/c1-9-11-12-13-20-43-30-17-14-28(15-18-30)37-29-16-19-34(33(23-29)36(39)42-10-2)38-44(40,41)35-31(25(5)6)21-27(24(3)4)22-32(35)26(7)8/h14-19,21-26,37-38H,9-13,20H2,1-8H3
InChIKey RAGVJNBXRUXZIJ-UHFFFAOYSA-N
Mol Weight 622.9 g/mol
Molecular Formula C36H50N2O5S
Exact Mass 622.344044 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IEl6GrJVhBP
Name Benzoic acid, 5-[[4-(hexyloxy)phenyl]amino]-2-[[[2,4,6-tris(1-methylethyl)phenyl]sulfonyl]amino]-, ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H50N2O5S
InChI InChI=1S/C36H50N2O5S/c1-9-11-12-13-20-43-30-17-14-28(15-18-30)37-29-16-19-34(33(23-29)36(39)42-10-2)38-44(40,41)35-31(25(5)6)21-27(24(3)4)22-32(35)26(7)8/h14-19,21-26,37-38H,9-13,20H2,1-8H3
InChIKey RAGVJNBXRUXZIJ-UHFFFAOYSA-N
Molecular Weight 622.865 g/mol
SMILES N(c1ccc(OCCCCCC)cc1)c1cc(c(cc1)NS(=O)(=O)c1c(cc(cc1C(C)C)C(C)C)C(C)C)C(=O)OCC
SPLASH splash10-0a4i-4839001000-4018dceeb88d02edca29
Source of Spectrum JX-2015-4-1334
Synonyms Ethyl 5-((4-(hexyloxy)phenyl)amino)-2-(2,4,6-triisopropylphenylsulfonamido)benzoate Ethyl 5-{[4-(hexyloxy)phenyl]amino}-2-({[2,4,6-tri(propan-2-yl)phenyl]sulfonyl}amino)benzoate 5-(4-hexoxyanilino)-2-[[2,4,6-tri(propan-2-yl)phenyl]sulfonylamino]benzoic acid ethyl ester Ethyl 5-(4-hexoxyanilino)-2-[[2,4,6-tri(propan-2-yl)phenyl]sulfonylamino]benzoate Ethyl 5-(4-hexoxyanilino)-2-[(2,4,6-triisopropylphenyl)sulfonylamino]benzoate Ethyl 5-[(4-hexoxyphenyl)amino]-2-[[2,4,6-tri(propan-2-yl)phenyl]sulfonylamino]benzoate
Wiley ID 1726722