| SpectraBase Spectrum ID |
6KM3Qs2Rnw7 |
| Name |
Racecadotril |
| CAS Registry Number |
81110-73-8 |
| Classification |
Antidiarrhoeal |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
385.134779395 u |
| Formula |
C21H23NO4S |
| InChI |
InChI=1S/C21H23NO4S/c1-16(23)27-15-19(12-17-8-4-2-5-9-17)21(25)22-13-20(24)26-14-18-10-6-3-7-11-18/h2-11,19H,12-15H2,1H3,(H,22,25)/t19-/m0/s1 |
| InChIKey |
ODUOJXZPIYUATO-IBGZPJMESA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
385.478 g/mol |
| Nominal Mass |
385 u |
| Quality |
926 |
| Retention Index |
2822 |
| SMILES |
[C@@](C(NCC(OCC=1C=CC=CC1)=O)=O)(CC1=CC=CC=C1)(CSC(=O)C)[H] |
| SPLASH |
splash10-0006-9610000000-e4bcfe8a5f3df372c693 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Benzyl (((2R)-3-(acetylsulfanyl)-2-benzylpropanoyl)amino)acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_031728 |
