CID 46314645

6-amino-5-phenylpyridine-3-carboxylic acid

Structural Information

Molecular Formula
C12H10N2O2
SMILES
C1=CC=C(C=C1)C2=C(N=CC(=C2)C(=O)O)N
InChI
InChI=1S/C12H10N2O2/c13-11-10(8-4-2-1-3-5-8)6-9(7-14-11)12(15)16/h1-7H,(H2,13,14)(H,15,16)
InChIKey
DPGNSCQEQVBQOA-UHFFFAOYSA-N
Compound name
6-amino-5-phenylpyridine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

214.07423 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.08151 146.2
[M+Na]+ 237.06345 159.8
[M+NH4]+ 232.10805 153.8
[M+K]+ 253.03739 153.8
[M-H]- 213.06695 149.8
[M+Na-2H]- 235.04890 154.8
[M]+ 214.07368 149.0
[M]- 214.07478 149.0
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.