SpectraBase Compound ID | AGNX65xNBBf |
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InChI | InChI=1S/C32H23N9O11S3.3Na/c33-23-15-24(34)31(41(42)43)16-29(23)39-38-28-11-10-27(21-7-5-17(13-22(21)28)53(44,45)46)36-35-25-8-9-26(20-4-2-1-3-19(20)25)37-40-30-14-18(54(47,48)49)6-12-32(30)55(50,51)52;;;/h1-16H,33-34H2,(H,44,45,46)(H,47,48,49)(H,50,51,52);;;/q;3*+1/p-3/b36-35+,39-38-,40-37-;;; |
InChIKey | RMHPZQCZAKANIS-SXWMKXOOSA-K |
Mol Weight | 871.71330785 g/mol |
Molecular Formula | C32H20N9Na3O11S3 |
Exact Mass | 871.013749 g/mol |
SpectraBase Spectrum ID | 7vCK54xGhYN |
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Name | 1,7-Cleveacid->4-nitro-m-phenylendiamine |
CAS Registry Number | 6388-25-6 |
Copyright | Copyright © 1989, 1990-2025 Wiley-VCH GmbH. All Rights Reserved. |
Formula | C32H20N9Na3O11S3 |
InChI | InChI=1S/C32H23N9O11S3.3Na/c33-23-15-24(34)31(41(42)43)16-29(23)39-38-28-11-10-27(21-7-5-17(13-22(21)28)53(44,45)46)36-35-25-8-9-26(20-4-2-1-3-19(20)25)37-40-30-14-18(54(47,48)49)6-12-32(30)55(50,51)52;;;/h1-16H,33-34H2,(H,44,45,46)(H,47,48,49)(H,50,51,52);;;/q;3*+1/p-3/b36-35+,39-38-,40-37-;;; |
InChIKey | RMHPZQCZAKANIS-SXWMKXOOSA-K |
Instrument Name | Bruker IFS 85 |
Synonyms | 2-Amino-p-benzoldisulfoacid->1-naphthylamine-> |
Technique | KBr-Pellet |