CID 456991

1-[2-naphthyl(phenyl)methyl]imidazole

Structural Information

Molecular Formula
C20H16N2
SMILES
C1=CC=C(C=C1)C(C2=CC3=CC=CC=C3C=C2)N4C=CN=C4
InChI
InChI=1S/C20H16N2/c1-2-7-17(8-3-1)20(22-13-12-21-15-22)19-11-10-16-6-4-5-9-18(16)14-19/h1-15,20H
InChIKey
QNZTYLLAFSAYRP-UHFFFAOYSA-N
Compound name
1-[naphthalen-2-yl(phenyl)methyl]imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.13135 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.13863 166.3
[M+Na]+ 307.12057 174.5
[M-H]- 283.12407 174.3
[M+NH4]+ 302.16517 181.2
[M+K]+ 323.09451 167.7
[M+H-H2O]+ 267.12861 155.9
[M+HCOO]- 329.12955 188.1
[M+CH3COO]- 343.14520 177.8
[M+Na-2H]- 305.10602 172.6
[M]+ 284.13080 166.3
[M]- 284.13190 166.3
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.