CID 5482474

N-benzyloxy-1-(4-fluorophenyl)-2-imidazol-1-yl-ethanimine

Structural Information

Molecular Formula
C18H16FN3O
SMILES
C1=CC=C(C=C1)CO/N=C(\CN2C=CN=C2)/C3=CC=C(C=C3)F
InChI
InChI=1S/C18H16FN3O/c19-17-8-6-16(7-9-17)18(12-22-11-10-20-14-22)21-23-13-15-4-2-1-3-5-15/h1-11,14H,12-13H2/b21-18+
InChIKey
GGJVKVNJJNOAKE-DYTRJAOYSA-N
Compound name
(Z)-1-(4-fluorophenyl)-2-imidazol-1-yl-N-phenylmethoxyethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

309.12775 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.13503 170.5
[M+Na]+ 332.11697 177.0
[M-H]- 308.12047 177.2
[M+NH4]+ 327.16157 183.7
[M+K]+ 348.09091 172.0
[M+H-H2O]+ 292.12501 158.6
[M+HCOO]- 354.12595 193.8
[M+CH3COO]- 368.14160 181.3
[M+Na-2H]- 330.10242 174.6
[M]+ 309.12720 170.6
[M]- 309.12830 170.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.