CID 216795

Brn 0882721

Structural Information

Molecular Formula
C13H11ClN2
SMILES
CN1C=CN2C1=CC(=C2)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C13H11ClN2/c1-15-6-7-16-9-11(8-13(15)16)10-2-4-12(14)5-3-10/h2-9H,1H3
InChIKey
IEIIWEQORZBHHJ-UHFFFAOYSA-N
Compound name
6-(4-chlorophenyl)-1-methylpyrrolo[1,2-a]imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

230.06108 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.06836 147.5
[M+Na]+ 253.05030 164.1
[M+NH4]+ 248.09490 157.7
[M+K]+ 269.02424 158.7
[M-H]- 229.05380 151.7
[M+Na-2H]- 251.03575 156.6
[M]+ 230.06053 151.6
[M]- 230.06163 151.6
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

No patent data available for this compound.