CID 511922

2-(2-adamantyl)-1-(cyclopropylmethyl)piperidine

Structural Information

Molecular Formula
C19H31N
SMILES
C1CCN(C(C1)C2C3CC4CC(C3)CC2C4)CC5CC5
InChI
InChI=1S/C19H31N/c1-2-6-20(12-13-4-5-13)18(3-1)19-16-8-14-7-15(10-16)11-17(19)9-14/h13-19H,1-12H2
InChIKey
DKUSLHULESVYCZ-UHFFFAOYSA-N
Compound name
2-(2-adamantyl)-1-(cyclopropylmethyl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

273.24564 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.25292 163.7
[M+Na]+ 296.23486 164.2
[M-H]- 272.23836 162.5
[M+NH4]+ 291.27946 178.1
[M+K]+ 312.20880 158.6
[M+H-H2O]+ 256.24290 153.7
[M+HCOO]- 318.24384 164.7
[M+CH3COO]- 332.25949 169.2
[M+Na-2H]- 294.22031 168.1
[M]+ 273.24509 160.0
[M]- 273.24619 160.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.