| SpectraBase Compound ID | 1k2S9K2T2w4 |
|---|---|
| InChI | InChI=1S/C26H45NO6S.Na/c1-16(4-9-24(30)27-12-13-34(31,32)33)20-7-8-21-19-6-5-17-14-18(28)10-11-25(17,2)22(19)15-23(29)26(20,21)3;/h16-23,28-29H,4-15H2,1-3H3,(H,27,30)(H,31,32,33);/q;+1/p-1/t16-,17-,18-,19+,20-,21+,22+,23+,25+,26-;/m1./s1 |
| InChIKey | YXHRQQJFKOHLAP-FVCKGWAHSA-M |
| Mol Weight | 521.68876928 g/mol |
| Molecular Formula | C26H44NNaO6S |
| Exact Mass | 521.278704 g/mol |
Transmission Infrared (IR) Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 6TbyQ7DTNkb |
|---|---|
| Name | 5β-Cholanic acid-3α, 12α-diol N-(2-sulfoethyl)amide, sodium salt |
| Source of Sample | Steraloids Inc. |
| Catalog Number | C1162-000 |
| Lot Number | H895 |
| CAS Registry Number | 1180-95-6 |
| Copyright | Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C26H44NNaO6S |
| InChI | InChI=1S/C26H45NO6S.Na/c1-16(4-9-24(30)27-12-13-34(31,32)33)20-7-8-21-19-6-5-17-14-18(28)10-11-25(17,2)22(19)15-23(29)26(20,21)3;/h16-23,28-29H,4-15H2,1-3H3,(H,27,30)(H,31,32,33);/q;+1/p-1/t16-,17-,18-,19+,20-,21+,22+,23+,25+,26-;/m1./s1 |
| InChIKey | YXHRQQJFKOHLAP-FVCKGWAHSA-M |
| Source of Spectrum | Forensic Spectral Research |
| Synonyms | Sodium taurodeoxycholate; Taurodeoxycholic acid, sodium salt |
| Technique | KBr0 |