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]+ 205.052706 142.4
[M+Na]+ 227.034648 152.0
[M-H]- 203.038154 146.4
[M+NH4]+ 222.079253 161.1
[M+K]+ 243.008588 146.7
[M+H-H2O]+ 187.042690 134.6
[M+HCOO]- 249.043631 160.3
[M+CH3COO]- 263.059281 155.5
[M+Na-2H]- 225.020096 146.9
[M]+ 204.04488142 143.2
[M]- 204.04597858 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.