| SpectraBase Compound ID | 9qXWnzn8ij |
|---|---|
| InChI | InChI=1S/C31H26N6O7S.2Na/c1-17-14-20(4-11-26(17)33-32-22-6-13-28(38)25(16-22)31(40)41)21-5-12-27(18(2)15-21)34-35-29-19(3)36-37(30(29)39)23-7-9-24(10-8-23)45(42,43)44;;/h4-16,29,38H,1-3H3,(H,40,41)(H,42,43,44);;/q;2*+1/p-2/b33-32+,35-34+;; |
| InChIKey | PNPXOULPRKFFQJ-NDRCTJIESA-L |
| Mol Weight | 670.60753856 g/mol |
| Molecular Formula | C31H24N6Na2O7S |
| Exact Mass | 670.122257 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | HWu0Xh3h7gn |
|---|---|
| Name | Direct Orange 31 |
| Catalog Number | 195278 |
| CAS Registry Number | 6420-03-7 |
| Copyright | Copyright © 2017-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2017-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C31H24N6Na2O7S |
| Formula (reported) | C31H24N6Na2O7S |
| InChI | InChI=1S/C31H26N6O7S.2Na/c1-17-14-20(4-11-26(17)33-32-22-6-13-28(38)25(16-22)31(40)41)21-5-12-27(18(2)15-21)34-35-29-19(3)36-37(30(29)39)23-7-9-24(10-8-23)45(42,43)44;;/h4-16,29,38H,1-3H3,(H,40,41)(H,42,43,44);;/q;2*+1/p-2/b33-32+,35-34+;; |
| InChIKey | PNPXOULPRKFFQJ-NDRCTJIESA-L |
| Wiley ID | SIAL_RAMAN_003405 |