CID 135517940

7-bromo-2-hydroxy-4h-pyrido[1,2-a]pyrimidin-4-one

Structural Information

Molecular Formula
C8H5BrN2O2
SMILES
C1=CC2=NC(=CC(=O)N2C=C1Br)O
InChI
InChI=1S/C8H5BrN2O2/c9-5-1-2-6-10-7(12)3-8(13)11(6)4-5/h1-4,12H
InChIKey
SVGJFNCVLKQSPN-UHFFFAOYSA-N
Compound name
7-bromo-2-hydroxypyrido[1,2-a]pyrimidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

239.95345 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.96073 137.1
[M+Na]+ 262.94267 151.5
[M-H]- 238.94617 141.4
[M+NH4]+ 257.98727 156.7
[M+K]+ 278.91661 139.9
[M+H-H2O]+ 222.95071 136.8
[M+HCOO]- 284.95165 156.0
[M+CH3COO]- 298.96730 185.7
[M+Na-2H]- 260.92812 147.5
[M]+ 239.95290 156.6
[M]- 239.95400 156.6
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