SpectraBase Compound ID | 1wuT778wygY |
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InChI | InChI=1S/4C36H26N8O11S3.12Na/c37-20-3-1-18-13-31(57(50,51)52)33(35(45)26(18)15-20)44-41-23-4-2-19-14-32(58(53,54)55)34(36(46)27(19)16-23)43-40-22-7-5-21(6-8-22)39-42-30-12-11-29(38)28-17-24(56(47,48)49)9-10-25(28)30;37-20-3-1-18-13-31(57(50,51)52)33(35(45)26(18)15-20)44-41-23-4-2-19-14-32(58(53,54)55)34(36(46)27(19)16-23)43-40-22-7-5-21(6-8-22)39-42-30-12-11-29(38)25-10-9-24(17-28(25)30)56(47,48)49;37-20-6-4-18-14-30(57(50,51)52)33(35(45)25(18)16-20)44-41-23-7-5-19-15-31(58(53,54)55)34(36(46)26(19)17-23)43-40-22-10-8-21(9-11-22)39-42-28-13-12-27(38)32-24(28)2-1-3-29(32)56(47,48)49;37-20-6-4-18-14-30(57(50,51)52)33(35(45)25(18)16-20)44-41-23-7-5-19-15-31(58(53,54)55)34(36(46)26(19)17-23)43-40-22-10-8-21(9-11-22)39-42-28-13-12-27(38)24-2-1-3-29(32(24)28)56(47,48)49;;;;;;;;;;;;/h4*1-17,45-46H,37-38H2,(H,47,48,49)(H,50,51,52)(H,53,54,55);;;;;;;;;;;;/q;;;;12*+1/p-12/b4*42-39+,43-40+,44-41+;;;;;;;;;;;; |
InChIKey | NVQDLKPKKPTKCD-YJFNCTISSA-B |
Mol Weight | 908.8 g/mol |
Molecular Formula | C36H23N8Na3O11S3 |
Exact Mass | 908.03415 g/mol |
SpectraBase Spectrum ID | 3R5PhoOFYpc |
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Name | diazophenyl black aw supra |
Color Properties | Color Index Name: direct black 80 Color Index Number: 31600 |
Conditions | Acidic |
Copyright | Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C37H27N8Na3O11S3 |
InChI | InChI=1S/4C36H26N8O11S3.12Na/c37-20-3-1-18-13-31(57(50,51)52)33(35(45)26(18)15-20)44-41-23-4-2-19-14-32(58(53,54)55)34(36(46)27(19)16-23)43-40-22-7-5-21(6-8-22)39-42-30-12-11-29(38)28-17-24(56(47,48)49)9-10-25(28)30;37-20-3-1-18-13-31(57(50,51)52)33(35(45)26(18)15-20)44-41-23-4-2-19-14-32(58(53,54)55)34(36(46)27(19)16-23)43-40-22-7-5-21(6-8-22)39-42-30-12-11-29(38)25-10-9-24(17-28(25)30)56(47,48)49;37-20-6-4-18-14-30(57(50,51)52)33(35(45)25(18)16-20)44-41-23-7-5-19-15-31(58(53,54)55)34(36(46)26(19)17-23)43-40-22-10-8-21(9-11-22)39-42-28-13-12-27(38)32-24(28)2-1-3-29(32)56(47,48)49;37-20-6-4-18-14-30(57(50,51)52)33(35(45)25(18)16-20)44-41-23-7-5-19-15-31(58(53,54)55)34(36(46)26(19)17-23)43-40-22-10-8-21(9-11-22)39-42-28-13-12-27(38)24-2-1-3-29(32(24)28)56(47,48)49;;;;;;;;;;;;/h4*1-17,45-46H,37-38H2,(H,47,48,49)(H,50,51,52)(H,53,54,55);;;;;;;;;;;;/q;;;;12*+1/p-12/b4*42-39+,43-40+,44-41+;;;;;;;;;;;; |
InChIKey | NVQDLKPKKPTKCD-YJFNCTISSA-B |
Sadtler UV Number | U697A |
Solvent | Water |