SpectraBase Compound ID | eMwGkZIEY8 |
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InChI | InChI=1S/C26H45NO7S.Na.H2O/c1-15(4-7-23(31)27-10-11-35(32,33)34)18-5-6-19-24-20(14-22(30)26(18,19)3)25(2)9-8-17(28)12-16(25)13-21(24)29;;/h15-22,24,28-30H,4-14H2,1-3H3,(H,27,31)(H,32,33,34);;1H2/q;+1;/p-1/t15-,16+,17-,18-,19+,20+,21-,22+,24+,25+,26-;;/m1../s1 |
InChIKey | RDAJAQDLEFHVNR-NEMAEHQESA-M |
Mol Weight | 555.70276928 g/mol |
Molecular Formula | C26H46NNaO8S |
Exact Mass | 555.284183 g/mol |
SpectraBase Spectrum ID | 26pnhVv2BAi |
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Name | Sodium taurocholate hydrate |
Source of Sample | Alfa Aesar |
Catalog Number | A18346 |
Lot Number | U12A008 |
CAS Registry Number | 345909-26-4 |
Copyright | Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C26H46NNaO8S |
InChI | InChI=1S/C26H45NO7S.Na.H2O/c1-15(4-7-23(31)27-10-11-35(32,33)34)18-5-6-19-24-20(14-22(30)26(18,19)3)25(2)9-8-17(28)12-16(25)13-21(24)29;;/h15-22,24,28-30H,4-14H2,1-3H3,(H,27,31)(H,32,33,34);;1H2/q;+1;/p-1/t15-,16+,17-,18-,19+,20+,21-,22+,24+,25+,26-;;/m1../s1 |
InChIKey | RDAJAQDLEFHVNR-NEMAEHQESA-M |
Instrument Name | Bruker Tensor 27 FT-IR |
KBr Capsule ID | K-01668 |
Physical State | Solid |
Purity | 97% |
Sample Type | Organic |
Source of Spectrum | Bio-Rad Laboratories, Inc. |
Synonyms | Taurocholic acid sodium salt hydrate |
Technique | KBr1 |