CID 202078

1-(1-ethylcyclohexyl)piperidine

Structural Information

Molecular Formula
C13H25N
SMILES
CCC1(CCCCC1)N2CCCCC2
InChI
InChI=1S/C13H25N/c1-2-13(9-5-3-6-10-13)14-11-7-4-8-12-14/h2-12H2,1H3
InChIKey
CGAAXKOJKBPCPI-UHFFFAOYSA-N
Compound name
1-(1-ethylcyclohexyl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

195.1987 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.205976 150.5
[M+Na]+ 218.187918 152.1
[M-H]- 194.191424 153.6
[M+NH4]+ 213.232523 169.6
[M+K]+ 234.161858 150.1
[M+H-H2O]+ 178.195960 142.6
[M+HCOO]- 240.196901 165.1
[M+CH3COO]- 254.212551 183.5
[M+Na-2H]- 216.173366 153.7
[M]+ 195.19815142 141.2
[M]- 195.19924858 141.2
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

patents stripe