CID 312385

N-phenyl-1h-imidazole-5-carboxamide

Structural Information

Molecular Formula
C10H9N3O
SMILES
C1=CC=C(C=C1)NC(=O)C2=CN=CN2
InChI
InChI=1S/C10H9N3O/c14-10(9-6-11-7-12-9)13-8-4-2-1-3-5-8/h1-7H,(H,11,12)(H,13,14)
InChIKey
HYPSKNLBXKFNBB-UHFFFAOYSA-N
Compound name
N-phenyl-1H-imidazole-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

9
References

33
Patents

187.07455 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.08183 140.0
[M+Na]+ 210.06377 151.6
[M+NH4]+ 205.10837 147.4
[M+K]+ 226.03771 147.6
[M-H]- 186.06727 142.3
[M+Na-2H]- 208.04922 148.1
[M]+ 187.07400 142.0
[M]- 187.07510 142.0
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