CID 221833

N-cyclohexyl-2,4-dichlorobenzamide

Structural Information

Molecular Formula
C13H15Cl2NO
SMILES
C1CCC(CC1)NC(=O)C2=C(C=C(C=C2)Cl)Cl
InChI
InChI=1S/C13H15Cl2NO/c14-9-6-7-11(12(15)8-9)13(17)16-10-4-2-1-3-5-10/h6-8,10H,1-5H2,(H,16,17)
InChIKey
FMFXAPQQVBRACZ-UHFFFAOYSA-N
Compound name
2,4-dichloro-N-cyclohexylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

271.05307 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.06035 159.5
[M+Na]+ 294.04229 165.7
[M-H]- 270.04579 164.6
[M+NH4]+ 289.08689 176.6
[M+K]+ 310.01623 159.8
[M+H-H2O]+ 254.05033 153.9
[M+HCOO]- 316.05127 170.7
[M+CH3COO]- 330.06692 196.8
[M+Na-2H]- 292.02774 161.4
[M]+ 271.05252 157.5
[M]- 271.05362 157.5
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.