CID 12333604

2-amino-1,8-naphthyridine-3-carboxylic acid

Structural Information

Molecular Formula
C9H7N3O2
SMILES
C1=CC2=CC(=C(N=C2N=C1)N)C(=O)O
InChI
InChI=1S/C9H7N3O2/c10-7-6(9(13)14)4-5-2-1-3-11-8(5)12-7/h1-4H,(H,13,14)(H2,10,11,12)
InChIKey
OWIABIJQOSFTKB-UHFFFAOYSA-N
Compound name
2-amino-1,8-naphthyridine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

189.05383 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.061106 137.6
[M+Na]+ 212.043048 147.0
[M-H]- 188.046554 138.3
[M+NH4]+ 207.087653 154.5
[M+K]+ 228.016988 143.6
[M+H-H2O]+ 172.051090 130.3
[M+HCOO]- 234.052031 158.0
[M+CH3COO]- 248.067681 182.4
[M+Na-2H]- 210.028496 145.5
[M]+ 189.05328142 136.1
[M]- 189.05437858 136.1
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