SpectraBase Spectrum ID |
DozDQPj9Egq |
Name |
Tetroxoprim |
CAS Registry Number |
53808-87-0 |
Classification |
Pharmaceutical drug, chemotherapeutic |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
334.164105200 u |
Formula |
C16H22N4O4 |
InChI |
InChI=1S/C16H22N4O4/c1-21-4-5-24-14-12(22-2)7-10(8-13(14)23-3)6-11-9-19-16(18)20-15(11)17/h7-9H,4-6H2,1-3H3,(H4,17,18,19,20) |
InChIKey |
WSWJIZXMAUYHOE-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
334.376 g/mol |
Nominal Mass |
334 u |
Quality |
928 |
Retention Index |
2708 |
SMILES |
NC1=NC=C(C(=N1)N)CC1=CC(=C(C(=C1)OC)OCCOC)OC |
SPLASH |
splash10-003r-2493000000-9c7e23813dcba98b600a |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
2,4-Diamino-5-[3,5-dimethoxy-4-(2-methoxyethoxy)benzyl]pyrimidin |
Technique |
GC/MS |
Wiley ID |
DD2024_006237 |