CID 58003

N-(4-butylcyclohexyl)butyramide

Structural Information

Molecular Formula
C14H27NO
SMILES
CCCCC1CCC(CC1)NC(=O)CCC
InChI
InChI=1S/C14H27NO/c1-3-5-7-12-8-10-13(11-9-12)15-14(16)6-4-2/h12-13H,3-11H2,1-2H3,(H,15,16)
InChIKey
KTHRUZYNRXNFEL-UHFFFAOYSA-N
Compound name
N-(4-butylcyclohexyl)butanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

225.20926 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.21654 158.1
[M+Na]+ 248.19848 166.6
[M+NH4]+ 243.24308 165.8
[M+K]+ 264.17242 159.7
[M-H]- 224.20198 160.1
[M+Na-2H]- 246.18393 161.3
[M]+ 225.20871 159.5
[M]- 225.20981 159.5
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.