CID 6476081

1-[2-[(e)-cinnamyl]oxy-2-(2,4-dichlorophenyl)ethyl]imidazole

Structural Information

Molecular Formula
C20H18Cl2N2O
SMILES
C1=CC=C(C=C1)/C=C/COC(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl
InChI
InChI=1S/C20H18Cl2N2O/c21-17-8-9-18(19(22)13-17)20(14-24-11-10-23-15-24)25-12-4-7-16-5-2-1-3-6-16/h1-11,13,15,20H,12,14H2/b7-4+
InChIKey
HWFUABFRDSLWLY-QPJJXVBHSA-N
Compound name
1-[2-(2,4-dichlorophenyl)-2-[(E)-3-phenylprop-2-enoxy]ethyl]imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

372.07962 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 373.08690 187.2
[M+Na]+ 395.06884 195.3
[M-H]- 371.07234 192.8
[M+NH4]+ 390.11344 199.2
[M+K]+ 411.04278 186.8
[M+H-H2O]+ 355.07688 177.0
[M+HCOO]- 417.07782 198.3
[M+CH3COO]- 431.09347 196.6
[M+Na-2H]- 393.05429 187.5
[M]+ 372.07907 191.5
[M]- 372.08017 191.5
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.