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

5
Patents

195.1987 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.20598 150.5
[M+Na]+ 218.18792 152.1
[M-H]- 194.19142 153.6
[M+NH4]+ 213.23252 169.6
[M+K]+ 234.16186 150.1
[M+H-H2O]+ 178.19596 142.6
[M+HCOO]- 240.19690 165.1
[M+CH3COO]- 254.21255 183.5
[M+Na-2H]- 216.17337 153.7
[M]+ 195.19815 141.2
[M]- 195.19925 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