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1-Naphthalenesulfonic acid, 5-(dimethylamino)-, 4-[2-[[[5-(dimethylamino)-1-naphthalenyl]sulfonyl]amino]-1-hydroxyethyl]-2-methoxyphenyl ester
SpectraBase Compound ID 1yWbG4xRol1
InChI InChI=1S/C33H35N3O7S2/c1-35(2)27-14-6-12-25-23(27)10-8-16-32(25)44(38,39)34-21-29(37)22-18-19-30(31(20-22)42-5)43-45(40,41)33-17-9-11-24-26(33)13-7-15-28(24)36(3)4/h6-20,29,34,37H,21H2,1-5H3
InChIKey OSAXSJFRJSAJOW-UHFFFAOYSA-N
Mol Weight 649.8 g/mol
Molecular Formula C33H35N3O7S2
Exact Mass 649.191643 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8oF77exrGdS
Name 1-Naphthalenesulfonic acid, 5-(dimethylamino)-, 4-[2-[[[5-(dimethylamino)-1-naphthalenyl]sulfonyl]amino]-1-hydroxyethyl]-2-methoxyphenyl ester
CAS Registry Number 36600-91-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H35N3O7S2
InChI InChI=1S/C33H35N3O7S2/c1-35(2)27-14-6-12-25-23(27)10-8-16-32(25)44(38,39)34-21-29(37)22-18-19-30(31(20-22)42-5)43-45(40,41)33-17-9-11-24-26(33)13-7-15-28(24)36(3)4/h6-20,29,34,37H,21H2,1-5H3
InChIKey OSAXSJFRJSAJOW-UHFFFAOYSA-N
Molecular Weight 649.777 g/mol
SMILES N(CC(c1ccc(c(c1)OC)OS(c1cccc2c1cccc2N(C)C)(=O)=O)O)S(c1cccc2c1cccc2N(C)C)(=O)=O
SPLASH splash10-00di-2910000000-0e4df847829097d5cd3d
Source of Spectrum W5-0-0-0
Synonyms 4-[2-(([5-(Dimethylamino)-1-naphthyl]sulfonyl)amino)-1-hydroxyethyl]-2-methoxyphenyl 5-(dimethylamino)-1-naphthalenesulfonate 5-(dimethylamino)-1-naphthalenesulfonic acid [4-[2-[[5-(dimethylamino)-1-naphthalenyl]sulfonylamino]-1-hydroxyethyl]-2-methoxyphenyl] ester [4-[2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-1-hydroxyethyl]-2-methoxyphenyl] 5-(dimethylamino)naphthalene-1-sulfonate [4-[2-[[5-(dimethylamino)-1-naphthyl]sulfonylamino]-1-hydroxy-ethyl]-2-methoxy-phenyl] 5-(dimethylamino)naphthalene-1-sulfonate [4-[2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-1-oxidanyl-ethyl]-2-methoxy-phenyl] 5-(dimethylamino)naphthalene-1-sulfonate
Wiley ID 1413071