| SpectraBase Spectrum ID |
DkA1vVWOrCa |
| Name |
Nadolol-M/A (-2H2O) AC |
| Classification |
Pharmaceutical drug metabolite derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
301.131408092 u |
| Formula |
C17H19NO4 |
| InChI |
InChI=1S/C17H19NO4/c1-12(19)18-9-4-10-21-17-6-3-5-14-7-8-15(11-16(14)17)22-13(2)20/h3-9,15H,10-11H2,1-2H3,(H,18,19)/b9-4+/t15-/m1/s1 |
| InChIKey |
YWDWMCPOBKJVQQ-BCFOUKGLSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
301.342 g/mol |
| Nominal Mass |
301 u |
| Quality |
909 |
| Retention Index |
2312 |
| SMILES |
C=12C(C=C[C@](C2)(OC(=O)C)[H])=CC=CC1OC\C=C\NC(=O)C |
| SPLASH |
splash10-0f6y-4932000000-f98e488b4154193b72ed |
| Sample Comments |
Structure uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
(2S)-8-(((2E)-3-(acetylamino)prop-2-en-1-yl)oxy)-1,2-dihydronaphthalen-2-yl acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_007957 |
