CID 208416

6-methyl-4-oxo-4h-pyrido[1,2-a]pyrimidine-3-carboxylic acid

Structural Information

Molecular Formula
C10H8N2O3
SMILES
CC1=CC=CC2=NC=C(C(=O)N12)C(=O)O
InChI
InChI=1S/C10H8N2O3/c1-6-3-2-4-8-11-5-7(10(14)15)9(13)12(6)8/h2-5H,1H3,(H,14,15)
InChIKey
BGVXSKKYJAOHOM-UHFFFAOYSA-N
Compound name
6-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

204.0535 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.06078 140.8
[M+Na]+ 227.04272 155.1
[M+NH4]+ 222.08732 147.8
[M+K]+ 243.01666 149.8
[M-H]- 203.04622 141.2
[M+Na-2H]- 225.02817 146.7
[M]+ 204.05295 142.8
[M]- 204.05405 142.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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