SpectraBase Spectrum ID |
2pLsM60fyZU |
Name |
Rivaroxaban |
Classification |
Pharmaceutical drug, anticoagulant |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
435.065569561 u |
Formula |
C19H18ClN3O5S |
InChI |
InChI=1S/C19H18ClN3O5S/c20-16-6-5-15(29-16)18(25)21-9-14-10-23(19(26)28-14)13-3-1-12(2-4-13)22-7-8-27-11-17(22)24/h1-6,14H,7-11H2,(H,21,25) |
InChIKey |
KGFYHTZWPPHNLQ-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
435.882 g/mol |
Nominal Mass |
435 u |
Quality |
999 |
Retention Index |
3342 |
SMILES |
C=1(N2C(OC(C2)CNC(C=2SC(=CC2)Cl)=O)=O)C=CC(N2C(COCC2)=O)=CC1 |
SPLASH |
splash10-0a4r-2930000000-97573a76c33d4087ac52 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
5-Chloro-N-[[2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]thiophene-\r2-carboxamide |
Technique |
GC/MS |
Wiley ID |
DD2024_025942 |