CID 54676228

Piroxicam

Structural Information

Molecular Formula
C15H13N3O4S
SMILES
CN1C(=C(C2=CC=CC=C2S1(=O)=O)O)C(=O)NC3=CC=CC=N3
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
Compound name
4-hydroxy-2-methyl-1,1-dioxo-N-pyridin-2-yl-1lambda6,2-benzothiazine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
8
Annotation Hits

3200
References

107503
Patents

331.06268 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 332.06996 171.0
[M+Na]+ 354.05190 180.9
[M-H]- 330.05540 175.3
[M+NH4]+ 349.09650 184.6
[M+K]+ 370.02584 175.7
[M+H-H2O]+ 314.05994 162.9
[M+HCOO]- 376.06088 185.4
[M+CH3COO]- 390.07653 205.6
[M+Na-2H]- 352.03735 176.5
[M]+ 331.06213 173.5
[M]- 331.06323 173.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.