CID 456990

[naphthyl(4-phenylphenyl)methyl]imidazole nitrate

Structural Information

Molecular Formula
C26H20N2
SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)C(C3=CC=CC4=CC=CC=C43)N5C=CN=C5
InChI
InChI=1S/C26H20N2/c1-2-7-20(8-3-1)21-13-15-23(16-14-21)26(28-18-17-27-19-28)25-12-6-10-22-9-4-5-11-24(22)25/h1-19,26H
InChIKey
FRAGQBSTPCVFQA-UHFFFAOYSA-N
Compound name
1-[naphthalen-1-yl-(4-phenylphenyl)methyl]imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

360.16266 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 361.16994 188.5
[M+Na]+ 383.15188 195.9
[M-H]- 359.15538 199.1
[M+NH4]+ 378.19648 199.6
[M+K]+ 399.12582 187.3
[M+H-H2O]+ 343.15992 176.3
[M+HCOO]- 405.16086 208.9
[M+CH3COO]- 419.17651 198.3
[M+Na-2H]- 381.13733 192.7
[M]+ 360.16211 187.8
[M]- 360.16321 187.8
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.