CID 101418635

2-chloro-n-cyclohexyl-n-[(cyclohexylamino)carbonyl]acetamide

Structural Information

Molecular Formula
C15H25ClN2O2
SMILES
C1CCC(CC1)NC(=O)N(C2CCCCC2)C(=O)CCl
InChI
InChI=1S/C15H25ClN2O2/c16-11-14(19)18(13-9-5-2-6-10-13)15(20)17-12-7-3-1-4-8-12/h12-13H,1-11H2,(H,17,20)
InChIKey
MOWFYDCENNHXHP-UHFFFAOYSA-N
Compound name
2-chloro-N-cyclohexyl-N-(cyclohexylcarbamoyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

300.16046 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 301.16774 172.7
[M+Na]+ 323.14968 172.1
[M-H]- 299.15318 177.9
[M+NH4]+ 318.19428 187.5
[M+K]+ 339.12362 169.5
[M+H-H2O]+ 283.15772 165.3
[M+HCOO]- 345.15866 184.9
[M+CH3COO]- 359.17431 206.4
[M+Na-2H]- 321.13513 171.3
[M]+ 300.15991 165.6
[M]- 300.16101 165.6
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.