| SpectraBase Spectrum ID |
JIF2jVjwNPs |
| Name |
Pravadoline |
| CAS Registry Number |
92623-83-1 |
| Classification |
Pharmaceutical drug, antiinflammatory, analgesic |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
378.194342702 u |
| Formula |
C23H26N2O3 |
| InChI |
InChI=1S/C23H26N2O3/c1-17-22(23(26)18-7-9-19(27-2)10-8-18)20-5-3-4-6-21(20)25(17)12-11-24-13-15-28-16-14-24/h3-10H,11-16H2,1-2H3 |
| InChIKey |
MEUQWHZOUDZXHH-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
378.472 g/mol |
| Nominal Mass |
378 u |
| Quality |
993 |
| Retention Index |
3344 |
| SMILES |
C=1(C=2C(N(C1C)CCN1CCOCC1)=CC=CC2)C(C1=CC=C(C=C1)OC)=O |
| SPLASH |
splash10-0udi-1901000000-3dbb3bf315f3b14aded2 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
WIN 48,098
(4-Methoxyphenyl)-[2-methyl-1-(2-morpholin-4-ylethyl)indol-3-yl]methanone |
| Technique |
GC/MS |
| Wiley ID |
DD2024_013633 |
