CID 3007435

1h-imidazole, 1-[1-(4-chlorophenyl)ethenyl]-

Structural Information

Molecular Formula
C11H9ClN2
SMILES
C=C(C1=CC=C(C=C1)Cl)N2C=CN=C2
InChI
InChI=1S/C11H9ClN2/c1-9(14-7-6-13-8-14)10-2-4-11(12)5-3-10/h2-8H,1H2
InChIKey
BNLOCOXFGGZLJW-UHFFFAOYSA-N
Compound name
1-[1-(4-chlorophenyl)ethenyl]imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

204.04543 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.05271 142.4
[M+Na]+ 227.03465 152.0
[M-H]- 203.03815 146.4
[M+NH4]+ 222.07925 161.1
[M+K]+ 243.00859 146.7
[M+H-H2O]+ 187.04269 134.6
[M+HCOO]- 249.04363 160.3
[M+CH3COO]- 263.05928 155.5
[M+Na-2H]- 225.02010 146.9
[M]+ 204.04488 143.2
[M]- 204.04598 143.2
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.