CID 55267135

(2e)-3-(1h-imidazol-2-yl)prop-2-enamide

Structural Information

Molecular Formula
C6H7N3O
SMILES
C1=CN=C(N1)/C=C/C(=O)N
InChI
InChI=1S/C6H7N3O/c7-5(10)1-2-6-8-3-4-9-6/h1-4H,(H2,7,10)(H,8,9)/b2-1+
InChIKey
PCLRNQYQHPROMR-OWOJBTEDSA-N
Compound name
(E)-3-(1H-imidazol-2-yl)prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

137.05891 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.06619 128.1
[M+Na]+ 160.04813 137.2
[M+NH4]+ 155.09273 134.5
[M+K]+ 176.02207 134.8
[M-H]- 136.05163 127.2
[M+Na-2H]- 158.03358 132.3
[M]+ 137.05836 128.6
[M]- 137.05946 128.6
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