CID 204149

2-phenylimidazo[1,2-a]pyrimidine

Structural Information

Molecular Formula
C12H9N3
SMILES
C1=CC=C(C=C1)C2=CN3C=CC=NC3=N2
InChI
InChI=1S/C12H9N3/c1-2-5-10(6-3-1)11-9-15-8-4-7-13-12(15)14-11/h1-9H
InChIKey
ONYRUSCZUWEZDP-UHFFFAOYSA-N
Compound name
2-phenylimidazo[1,2-a]pyrimidine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

5
References

64
Patents

195.07965 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.086926 139.6
[M+Na]+ 218.068868 150.6
[M-H]- 194.072374 143.9
[M+NH4]+ 213.113473 157.6
[M+K]+ 234.042808 145.7
[M+H-H2O]+ 178.076910 130.5
[M+HCOO]- 240.077851 162.7
[M+CH3COO]- 254.093501 153.3
[M+Na-2H]- 216.054316 149.2
[M]+ 195.07910142 140.8
[M]- 195.08019858 140.8
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

patents stripe