| SpectraBase Spectrum ID |
B4YT3rLm2Ii |
| Name |
Papaverine-M (O-Desmethyl) AC |
| Classification |
Pharmaceutical drug metabolite |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
367.141972775 u |
| Formula |
C21H21NO5 |
| InChI |
InChI=1S/C21H21NO5/c1-13(23)27-21-10-14(5-6-18(21)24-2)9-17-16-12-20(26-4)19(25-3)11-15(16)7-8-22-17/h5-8,10-12H,9H2,1-4H3 |
| InChIKey |
JOMXVMKTUKABRZ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
367.401 g/mol |
| Nominal Mass |
367 u |
| Quality |
919 |
| Retention Index |
2801 |
| SMILES |
C1=2C(=CC(=C(C2)OC)OC)C=CN=C1CC1=CC(=C(C=C1)OC)OC(=O)C |
| SPLASH |
splash10-02mi-1459000000-cdee9841b8357ff90282 |
| Sample Comments |
Structure uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
5-((6,7-dimethoxyisoquinolin-1-yl)methyl)-2-methoxyphenyl acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_003478 |
