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]+ 259.12298 158.0
[M+Na]+ 281.10492 168.4
[M-H]- 257.10842 167.1
[M+NH4]+ 276.14952 176.5
[M+K]+ 297.07886 162.2
[M+H-H2O]+ 241.11296 149.0
[M+HCOO]- 303.11390 182.6
[M+CH3COO]- 317.12955 171.3
[M+Na-2H]- 279.09037 162.7
[M]+ 258.11515 159.5
[M]- 258.11625 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.