SpectraBase Compound ID | B1vDU8GDmT6 |
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InChI | InChI=1S/C38H27N5O14S3.3Na/c44-32-17-27(58(49,50)51)14-20-11-24(5-8-29(20)32)39-37(47)19-1-3-23(4-2-19)42-43-35-34(60(55,56)57)16-22-13-26(7-10-31(22)36(35)46)41-38(48)40-25-6-9-30-21(12-25)15-28(18-33(30)45)59(52,53)54;;;/h1-18,44-46H,(H,39,47)(H2,40,41,48)(H,49,50,51)(H,52,53,54)(H,55,56,57);;;/q;3*+1/p-3/b43-42+;;; |
InChIKey | GWLHWTCCEOJCDB-DMGLIUGYSA-K |
Mol Weight | 939.78030785 g/mol |
Molecular Formula | C38H24N5Na3O14S3 |
Exact Mass | 939.017497 g/mol |
SpectraBase Spectrum ID | El6E9vjjulv |
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Name | 2-Naphthalenesulfonic acid, 3-[[p-[(5-hydroxy-7-sulfo-2-naphthyl)carbamoyl]phenyl]azo]-7,7'-ureylenebis[4-hydroxy-, trisodium salt |
CAS Registry Number | 6369-39-7 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C38H24N5Na3O14S3 |
InChI | InChI=1S/C38H27N5O14S3.3Na/c44-32-17-27(58(49,50)51)14-20-11-24(5-8-29(20)32)39-37(47)19-1-3-23(4-2-19)42-43-35-34(60(55,56)57)16-22-13-26(7-10-31(22)36(35)46)41-38(48)40-25-6-9-30-21(12-25)15-28(18-33(30)45)59(52,53)54;;;/h1-18,44-46H,(H,39,47)(H2,40,41,48)(H,49,50,51)(H,52,53,54)(H,55,56,57);;;/q;3*+1/p-3/b43-42+;;; |
InChIKey | GWLHWTCCEOJCDB-DMGLIUGYSA-K |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |