CID 37175

Imazalil

Structural Information

Molecular Formula
C14H14Cl2N2O
SMILES
C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl
InChI
InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2
InChIKey
PZBPKYOVPCNPJY-UHFFFAOYSA-N
Compound name
1-[2-(2,4-dichlorophenyl)-2-prop-2-enoxyethyl]imidazole
Related CIDs

2D Structure

compound 2d structure
8
Annotation Hits

264
References

50878
Patents

296.0483 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.05558 165.3
[M+Na]+ 319.03752 174.6
[M-H]- 295.04102 168.3
[M+NH4]+ 314.08212 180.8
[M+K]+ 335.01146 167.9
[M+H-H2O]+ 279.04556 157.2
[M+HCOO]- 341.04650 177.1
[M+CH3COO]- 355.06215 199.6
[M+Na-2H]- 317.02297 166.6
[M]+ 296.04775 169.8
[M]- 296.04885 169.8
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.