CID 14301

N-cyclohexylacetamide

Structural Information

Molecular Formula
C8H15NO
SMILES
CC(=O)NC1CCCCC1
InChI
InChI=1S/C8H15NO/c1-7(10)9-8-5-3-2-4-6-8/h8H,2-6H2,1H3,(H,9,10)
InChIKey
WRAGCBBWIYQMRF-UHFFFAOYSA-N
Compound name
N-cyclohexylacetamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

3
References

1516
Patents

141.11537 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.122646 131.6
[M+Na]+ 164.104588 135.4
[M-H]- 140.108094 134.2
[M+NH4]+ 159.149193 152.5
[M+K]+ 180.078528 134.9
[M+H-H2O]+ 124.112630 125.9
[M+HCOO]- 186.113571 152.5
[M+CH3COO]- 200.129221 175.5
[M+Na-2H]- 162.090036 136.3
[M]+ 141.11482142 126.0
[M]- 141.11591858 126.0
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

patents stripe