SpectraBase Spectrum ID |
DlQd1f1mMEK |
Name |
Piroxicam |
CAS Registry Number |
36322-90-4 |
Classification |
Pharmaceutical drug, anti-inflammatory |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
331.062677081 u |
Formula |
C15H13N3O4S |
InChI |
InChI=1S/C15H13N3O4S/c1-18-13(15(20)17-12-8-4-5-9-16-12)14(19)10-6-2-3-7-11(10)23(18,21)22/h2-9,19H,1H3,(H,16,17,20) |
InChIKey |
QYSPLQLAKJAUJT-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
331.346 g/mol |
Nominal Mass |
331 u |
Quality |
923 |
Retention Index |
2653 |
SMILES |
OC1=C(N(S(C=2C1=CC=CC2)(=O)=O)C)C(NC=1N=CC=CC1)=O |
SPLASH |
splash10-00dj-4911000000-df1ad66da5c8dab0af1b |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
3-[Hydroxy-(pyridin-2-ylamino)methylidene]-4-methyl-5,5-dioxo-5(6)-thia-4-azabicyclo[4.4.0]- \rdeca-6,8,10-trien-2-one |
Technique |
GC/MS |
Wiley ID |
DD2024_003696 |