| SpectraBase Compound ID | 2zXYFHLAIsn |
|---|---|
| InChI | InChI=1S/C22H15ClN2O8S2.Ba/c23-14-6-9-19(33-15-4-2-1-3-5-15)18(12-14)24-25-21-17-8-7-16(34(27,28)29)10-13(17)11-20(22(21)26)35(30,31)32;/h1-12,26H,(H,27,28,29)(H,30,31,32);/q;+2/p-2/b25-24+; |
| InChIKey | SHBMUZREHRIYHC-QREUMGABSA-L |
| Mol Weight | 670.25 g/mol |
| Molecular Formula | C22H13BaClN2O8S2 |
| Exact Mass | 669.885432 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | DIfhnz1jCsE |
|---|---|
| Name | 5-Chloro-2-phenoxyaniline -> 2-naphthol-3,6-disulfonic acid, ba-salt |
| Source of Sample | Bayer |
| Color Properties | Colour Index Name= Pigment Red 94 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C22H13BaClN2O8S2 |
| Hummel Decimal Number | 012213 |
| InChI | InChI=1S/C22H15ClN2O8S2.Ba/c23-14-6-9-19(33-15-4-2-1-3-5-15)18(12-14)24-25-21-17-8-7-16(34(27,28)29)10-13(17)11-20(22(21)26)35(30,31)32;/h1-12,26H,(H,27,28,29)(H,30,31,32);/q;+2/p-2/b25-24+; |
| InChIKey | SHBMUZREHRIYHC-QREUMGABSA-L |
| Sample Description | Red solid |
| Synonyms | Helio Echtrottoner 3B |
| Technique | KBr pellet |