CID 213031

Fenhexamid

Structural Information

Molecular Formula
C14H17Cl2NO2
SMILES
CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl
InChI
InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)
InChIKey
VDLGAVXLJYLFDH-UHFFFAOYSA-N
Compound name
N-(2,3-dichloro-4-hydroxyphenyl)-1-methylcyclohexane-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
8
Annotation Hits

86
References

33700
Patents

301.06363 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 302.07091 164.7
[M+Na]+ 324.05285 172.0
[M-H]- 300.05635 169.2
[M+NH4]+ 319.09745 182.3
[M+K]+ 340.02679 166.0
[M+H-H2O]+ 284.06089 160.4
[M+HCOO]- 346.06183 174.6
[M+CH3COO]- 360.07748 200.1
[M+Na-2H]- 322.03830 166.5
[M]+ 301.06308 163.5
[M]- 301.06418 163.5
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.