CID 216985

1,6-diphenyl-1h-pyrrolo[1,2-a]imidazole

Structural Information

Molecular Formula
C18H14N2
SMILES
C1=CC=C(C=C1)C2=CN3C=CN(C3=C2)C4=CC=CC=C4
InChI
InChI=1S/C18H14N2/c1-3-7-15(8-4-1)16-13-18-19(14-16)11-12-20(18)17-9-5-2-6-10-17/h1-14H
InChIKey
DYYIOEADAJTDAY-UHFFFAOYSA-N
Compound name
1,6-diphenylpyrrolo[1,2-a]imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.1157 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.122976 158.0
[M+Na]+ 281.104918 168.4
[M-H]- 257.108424 167.1
[M+NH4]+ 276.149523 176.5
[M+K]+ 297.078858 162.2
[M+H-H2O]+ 241.112960 149.0
[M+HCOO]- 303.113901 182.6
[M+CH3COO]- 317.129551 171.3
[M+Na-2H]- 279.090366 162.7
[M]+ 258.11515142 159.5
[M]- 258.11624858 159.5
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.