| SpectraBase Spectrum ID |
GXDdjZqYNGq |
| Name |
Trimethoprim 2AC |
| Classification |
Pharmaceutical drug derivative |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
374.159019819 u |
| Formula |
C18H22N4O5 |
| InChI |
InChI=1S/C18H22N4O5/c1-10(23)20-17-13(9-19-18(22-17)21-11(2)24)6-12-7-14(25-3)16(27-5)15(8-12)26-4/h7-9H,6H2,1-5H3,(H2,19,20,21,22,23,24) |
| InChIKey |
UXRXKBGRKRYPCP-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
374.397 g/mol |
| Nominal Mass |
374 u |
| Quality |
934 |
| Retention Index |
3069 |
| SMILES |
C=1(C(CC2=CC(=C(C(=C2)OC)OC)OC)=CN=C(N1)NC(=O)C)NC(=O)C |
| SPLASH |
splash10-06fr-1569000000-3dfe5a1c092d64a6f2c3 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
N-(2-(acetylamino)-5-(3,4,5-trimethoxybenzyl)pyrimidin-4-yl)acetamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_004131 |
