CID 54676301

5'-hydroxypiroxicam

Structural Information

Molecular Formula
C15H13N3O5S
SMILES
CN1C(=C(C2=CC=CC=C2S1(=O)=O)O)C(=O)NC3=NC=C(C=C3)O
InChI
InChI=1S/C15H13N3O5S/c1-18-13(15(21)17-12-7-6-9(19)8-16-12)14(20)10-4-2-3-5-11(10)24(18,22)23/h2-8,19-20H,1H3,(H,16,17,21)
InChIKey
CCKOORANQAQKKV-UHFFFAOYSA-N
Compound name
4-hydroxy-N-(5-hydroxypyridin-2-yl)-2-methyl-1,1-dioxo-1lambda6,2-benzothiazine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

12
References

4
Patents

347.0576 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 348.06488 174.6
[M+Na]+ 370.04682 187.2
[M+NH4]+ 365.09142 181.2
[M+K]+ 386.02076 179.0
[M-H]- 346.05032 176.2
[M+Na-2H]- 368.03227 181.5
[M]+ 347.05705 177.2
[M]- 347.05815 177.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe