CID 3044698

4,5-dihydro-2-(2,2-diphenylcyclopropyl)-1-(p-methylbenzyl)-1h-imidazole hydrochloride

Structural Information

Molecular Formula
C26H26N2
SMILES
CC1=CC=C(C=C1)CN2CCN=C2C3CC3(C4=CC=CC=C4)C5=CC=CC=C5
InChI
InChI=1S/C26H26N2/c1-20-12-14-21(15-13-20)19-28-17-16-27-25(28)24-18-26(24,22-8-4-2-5-9-22)23-10-6-3-7-11-23/h2-15,24H,16-19H2,1H3
InChIKey
MXQCMFKQRJYXEO-UHFFFAOYSA-N
Compound name
2-(2,2-diphenylcyclopropyl)-1-[(4-methylphenyl)methyl]-4,5-dihydroimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

366.2096 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 367.21688 189.5
[M+Na]+ 389.19882 197.7
[M-H]- 365.20232 202.1
[M+NH4]+ 384.24342 197.4
[M+K]+ 405.17276 190.9
[M+H-H2O]+ 349.20686 178.4
[M+HCOO]- 411.20780 209.7
[M+CH3COO]- 425.22345 199.0
[M+Na-2H]- 387.18427 190.7
[M]+ 366.20905 189.7
[M]- 366.21015 189.7
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.