| SpectraBase Spectrum ID |
5V6Tt5GDVYG |
| Name |
Oxyphenbutazone (Enol) 2AC |
| Classification |
Pharmaceutical drug derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
408.168521876 u |
| Formula |
C23H24N2O5 |
| InChI |
InChI=1S/C23H24N2O5/c1-4-5-11-21-22(28)24(19-12-14-20(15-13-19)29-16(2)26)25(23(21)30-17(3)27)18-9-7-6-8-10-18/h6-10,12-15H,4-5,11H2,1-3H3 |
| InChIKey |
UEJUCNRJTPOHSF-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
408.454 g/mol |
| Nominal Mass |
408 u |
| Quality |
986 |
| Retention Index |
2815 |
| SMILES |
C1(N(N(C(=C1CCCC)OC(=O)C)C=1C=CC=CC1)C=1C=CC(=CC1)OC(=O)C)=O |
| SPLASH |
splash10-052f-9521000000-30dfec87423741f72c76 |
| Sample Comments |
Enolisation direction uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
4-(3-(acetyloxy)-4-butyl-5-oxo-2-phenyl-2,5-dihydro-1H-pyrazol-1-yl)phenyl acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_006499 |
