CID 577018

Imidazo[1,2-a]pyrimidine

Structural Information

Molecular Formula
C6H5N3
SMILES
C1=CN2C=CN=C2N=C1
InChI
InChI=1S/C6H5N3/c1-2-7-6-8-3-5-9(6)4-1/h1-5H
InChIKey
INSWZAQOISIYDT-UHFFFAOYSA-N
Compound name
imidazo[1,2-a]pyrimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

13
References

4860
Patents

119.04835 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 120.05563 118.8
[M+Na]+ 142.03757 133.6
[M+NH4]+ 137.08217 128.1
[M+K]+ 158.01151 128.5
[M-H]- 118.04107 120.1
[M+Na-2H]- 140.02302 127.6
[M]+ 119.04780 121.3
[M]- 119.04890 121.3
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