CID 55265281

Methyl 1,8-naphthyridine-4-carboxylate

Structural Information

Molecular Formula
C10H8N2O2
SMILES
COC(=O)C1=C2C=CC=NC2=NC=C1
InChI
InChI=1S/C10H8N2O2/c1-14-10(13)8-4-6-12-9-7(8)3-2-5-11-9/h2-6H,1H3
InChIKey
OLCRSKVYJXNGLF-UHFFFAOYSA-N
Compound name
methyl 1,8-naphthyridine-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

188.05858 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.06586 137.4
[M+Na]+ 211.04780 146.8
[M-H]- 187.05130 139.5
[M+NH4]+ 206.09240 155.4
[M+K]+ 227.02174 144.4
[M+H-H2O]+ 171.05584 129.7
[M+HCOO]- 233.05678 158.5
[M+CH3COO]- 247.07243 181.7
[M+Na-2H]- 209.03325 146.6
[M]+ 188.05803 139.3
[M]- 188.05913 139.3
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.