| SpectraBase Compound ID | 8lv1Ld7kVU9 |
|---|---|
| InChI | InChI=1S/C28H30N2O3.H2O/c1-5-29(6-2)19-13-15-23-25(17-19)33-26-18-20(30(7-3)8-4)14-16-24(26)27(23)21-11-9-10-12-22(21)28(31)32;/h9-18H,5-8H2,1-4H3;1H2 |
| InChIKey | ROBRTKNZGHQYCR-UHFFFAOYSA-N |
| Mol Weight | 460.574 g/mol |
| Molecular Formula | C28H32N2O4 |
| Exact Mass | 460.236208 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | KShDkLnrYQV |
|---|---|
| Name | Xanthylium, 9-(2-carboxyphenyl)-3,6-bis(diethylamino)-, hydroxide |
| CAS Registry Number | 14899-08-2 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C28H31N2O4 |
| InChI | InChI=1S/C28H30N2O3.H2O/c1-5-29(6-2)19-13-15-23-25(17-19)33-26-18-20(30(7-3)8-4)14-16-24(26)27(23)21-11-9-10-12-22(21)28(31)32;/h9-18H,5-8H2,1-4H3;1H2 |
| InChIKey | ROBRTKNZGHQYCR-UHFFFAOYSA-N |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |