CID 3040026

51491-48-6

Structural Information

Molecular Formula
C19H28N2O
SMILES
CN1CC(CC(C1)C(=O)NC2CCCCC2)C3=CC=CC=C3
InChI
InChI=1S/C19H28N2O/c1-21-13-16(15-8-4-2-5-9-15)12-17(14-21)19(22)20-18-10-6-3-7-11-18/h2,4-5,8-9,16-18H,3,6-7,10-14H2,1H3,(H,20,22)
InChIKey
JDADZMPAJBUKLU-UHFFFAOYSA-N
Compound name
N-cyclohexyl-1-methyl-5-phenylpiperidine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

300.22015 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 301.22743 174.8
[M+Na]+ 323.20937 175.2
[M-H]- 299.21287 180.7
[M+NH4]+ 318.25397 187.1
[M+K]+ 339.18331 171.0
[M+H-H2O]+ 283.21741 164.6
[M+HCOO]- 345.21835 189.2
[M+CH3COO]- 359.23400 206.3
[M+Na-2H]- 321.19482 174.4
[M]+ 300.21960 164.8
[M]- 300.22070 164.8
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.