CID 59577

Acetamide, n-(4-benzylcyclohexyl)-

Structural Information

Molecular Formula
C15H21NO
SMILES
CC(=O)NC1CCC(CC1)CC2=CC=CC=C2
InChI
InChI=1S/C15H21NO/c1-12(17)16-15-9-7-14(8-10-15)11-13-5-3-2-4-6-13/h2-6,14-15H,7-11H2,1H3,(H,16,17)
InChIKey
MHHGDPVUHFIQTH-UHFFFAOYSA-N
Compound name
N-(4-benzylcyclohexyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

231.16231 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.16959 155.1
[M+Na]+ 254.15153 158.3
[M-H]- 230.15503 160.5
[M+NH4]+ 249.19613 172.2
[M+K]+ 270.12547 155.1
[M+H-H2O]+ 214.15957 147.5
[M+HCOO]- 276.16051 175.3
[M+CH3COO]- 290.17616 193.4
[M+Na-2H]- 252.13698 158.0
[M]+ 231.16176 149.9
[M]- 231.16286 149.9
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.