CID 16774635

67387-53-5

Structural Information

Molecular Formula
C12H10N2O5
SMILES
CC1=C(C=NO1)C(=O)NC2=CC(=C(C=C2)C(=O)O)O
InChI
InChI=1S/C12H10N2O5/c1-6-9(5-13-19-6)11(16)14-7-2-3-8(12(17)18)10(15)4-7/h2-5,15H,1H3,(H,14,16)(H,17,18)
InChIKey
GKONVPBORWAFJL-UHFFFAOYSA-N
Compound name
2-hydroxy-4-[(5-methyl-1,2-oxazole-4-carbonyl)amino]benzoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

262.05896 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.06624 156.8
[M+Na]+ 285.04818 166.9
[M+NH4]+ 280.09278 161.5
[M+K]+ 301.02212 166.4
[M-H]- 261.05168 158.4
[M+Na-2H]- 283.03363 160.6
[M]+ 262.05841 158.2
[M]- 262.05951 158.2
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

patents stripe