CID 460820

2-(4-phenylphenyl)imidazo[1,2-a]pyrimidin-3-ol

Structural Information

Molecular Formula
C18H13N3O
SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)C3=C(N4C=CC=NC4=N3)O
InChI
InChI=1S/C18H13N3O/c22-17-16(20-18-19-11-4-12-21(17)18)15-9-7-14(8-10-15)13-5-2-1-3-6-13/h1-12,22H
InChIKey
ZRWMMBMPZGACCT-UHFFFAOYSA-N
Compound name
2-(4-phenylphenyl)imidazo[1,2-a]pyrimidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

287.10587 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.11315 165.8
[M+Na]+ 310.09509 176.6
[M-H]- 286.09859 172.2
[M+NH4]+ 305.13969 179.1
[M+K]+ 326.06903 169.2
[M+H-H2O]+ 270.10313 155.4
[M+HCOO]- 332.10407 186.6
[M+CH3COO]- 346.11972 177.4
[M+Na-2H]- 308.08054 172.4
[M]+ 287.10532 166.7
[M]- 287.10642 166.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.