CID 456993

1-[(4-fluorophenyl)-(2-naphthyl)methyl]imidazole

Structural Information

Molecular Formula
C20H15FN2
SMILES
C1=CC=C2C=C(C=CC2=C1)C(C3=CC=C(C=C3)F)N4C=CN=C4
InChI
InChI=1S/C20H15FN2/c21-19-9-7-16(8-10-19)20(23-12-11-22-14-23)18-6-5-15-3-1-2-4-17(15)13-18/h1-14,20H
InChIKey
AWXKEGFKCCSJKT-UHFFFAOYSA-N
Compound name
1-[(4-fluorophenyl)-naphthalen-2-ylmethyl]imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

302.12192 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.12920 169.7
[M+Na]+ 325.11114 178.9
[M-H]- 301.11464 176.7
[M+NH4]+ 320.15574 184.1
[M+K]+ 341.08508 171.6
[M+H-H2O]+ 285.11918 158.5
[M+HCOO]- 347.12012 190.4
[M+CH3COO]- 361.13577 181.0
[M+Na-2H]- 323.09659 174.6
[M]+ 302.12137 169.2
[M]- 302.12247 169.2
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.