SpectraBase Compound ID | cfaafKKbrH |
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InChI | InChI=1S/C34H28N6O16S4.4Na/c1-55-23-11-15(3-7-19(23)37-39-21-9-5-17-25(57(43,44)45)13-27(59(49,50)51)31(35)29(17)33(21)41)16-4-8-20(24(12-16)56-2)38-40-22-10-6-18-26(58(46,47)48)14-28(60(52,53)54)32(36)30(18)34(22)42;;;;/h3-14,41-42H,35-36H2,1-2H3,(H,43,44,45)(H,46,47,48)(H,49,50,51)(H,52,53,54);;;;/q;4*+1/p-4/b39-37+,40-38+;;;; |
InChIKey | BPHHNXJPFPEJOF-GPTZEZBUSA-J |
Mol Weight | 992.79107713 g/mol |
Molecular Formula | C34H24N6Na4O16S4 |
Exact Mass | 991.972241 g/mol |
SpectraBase Spectrum ID | 8ErGAPPxJae |
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Name | C.I. DIRECT BLUE 1 |
Source of Sample | Fluka Chemie AG, Buchs, Switzerland |
Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C34H24N6Na4O16S4 |
InChI | InChI=1S/C34H28N6O16S4.4Na/c1-55-23-11-15(3-7-19(23)37-39-21-9-5-17-25(57(43,44)45)13-27(59(49,50)51)31(35)29(17)33(21)41)16-4-8-20(24(12-16)56-2)38-40-22-10-6-18-26(58(46,47)48)14-28(60(52,53)54)32(36)30(18)34(22)42;;;;/h3-14,41-42H,35-36H2,1-2H3,(H,43,44,45)(H,46,47,48)(H,49,50,51)(H,52,53,54);;;;/q;4*+1/p-4/b39-37+,40-38+;;;; |
InChIKey | BPHHNXJPFPEJOF-GPTZEZBUSA-J |
Molecular Weight | 992.794240 |
Synonyms | 1,3-NAPHTHALENEDISULFONIC ACID, 6,6*- //3,3*-DIMETHOXY-4,4*-BIPHENYLYLENE/- BIS/AZO//BIS/4-AMINO-5-HYDROXY-, TETRASODIUM SALT C.I. DIRECT BLUE 1 CHICAGO BLUE 6B |
Technique | KBr WAFER |