CID 3633284

2-chloro-n-(2-methylcyclohexyl)acetamide

Structural Information

Molecular Formula
C9H16ClNO
SMILES
CC1CCCCC1NC(=O)CCl
InChI
InChI=1S/C9H16ClNO/c1-7-4-2-3-5-8(7)11-9(12)6-10/h7-8H,2-6H2,1H3,(H,11,12)
InChIKey
SOESMQGNIBIAOH-UHFFFAOYSA-N
Compound name
2-chloro-N-(2-methylcyclohexyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

189.09204 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.09932 142.4
[M+Na]+ 212.08126 147.6
[M-H]- 188.08476 145.0
[M+NH4]+ 207.12586 162.5
[M+K]+ 228.05520 144.6
[M+H-H2O]+ 172.08930 137.6
[M+HCOO]- 234.09024 158.4
[M+CH3COO]- 248.10589 183.5
[M+Na-2H]- 210.06671 145.3
[M]+ 189.09149 139.5
[M]- 189.09259 139.5
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.