CID 555963

N-(2-pyridinyl)oxamic acid hydrochloride

Structural Information

Molecular Formula
C7H6N2O3
SMILES
C1=CC=NC(=C1)NC(=O)C(=O)O
InChI
InChI=1S/C7H6N2O3/c10-6(7(11)12)9-5-3-1-2-4-8-5/h1-4H,(H,11,12)(H,8,9,10)
InChIKey
RQLBRIIHVJSCTG-UHFFFAOYSA-N
Compound name
2-oxo-2-(pyridin-2-ylamino)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

16
Patents

166.03784 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.045116 131.5
[M+Na]+ 189.027058 138.5
[M-H]- 165.030564 132.7
[M+NH4]+ 184.071663 149.4
[M+K]+ 205.000998 137.4
[M+H-H2O]+ 149.035100 124.9
[M+HCOO]- 211.036041 154.1
[M+CH3COO]- 225.051691 174.9
[M+Na-2H]- 187.012506 138.2
[M]+ 166.03729142 130.0
[M]- 166.03838858 130.0
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