CID 5153132

N-(cyclohexylmethyl)-2-phenoxyacetamide

Structural Information

Molecular Formula
C15H21NO2
SMILES
C1CCC(CC1)CNC(=O)COC2=CC=CC=C2
InChI
InChI=1S/C15H21NO2/c17-15(12-18-14-9-5-2-6-10-14)16-11-13-7-3-1-4-8-13/h2,5-6,9-10,13H,1,3-4,7-8,11-12H2,(H,16,17)
InChIKey
WBJVENNSWCXEPN-UHFFFAOYSA-N
Compound name
N-(cyclohexylmethyl)-2-phenoxyacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

247.15723 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.164506 158.2
[M+Na]+ 270.146448 160.3
[M-H]- 246.149954 163.2
[M+NH4]+ 265.191053 174.2
[M+K]+ 286.120388 157.7
[M+H-H2O]+ 230.154490 150.1
[M+HCOO]- 292.155431 178.6
[M+CH3COO]- 306.171081 194.4
[M+Na-2H]- 268.131896 161.9
[M]+ 247.15668142 154.0
[M]- 247.15777858 154.0
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.