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 149.9
[M+Na]+ 253.05030 162.9
[M-H]- 229.05380 156.1
[M+NH4]+ 248.09490 171.2
[M+K]+ 269.02424 156.8
[M+H-H2O]+ 213.05834 142.7
[M+HCOO]- 275.05928 170.1
[M+CH3COO]- 289.07493 164.3
[M+Na-2H]- 251.03575 153.9
[M]+ 230.06053 154.7
[M]- 230.06163 154.7
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.