CID 11971399

N-(1,2,5-trimethylpiperidyl-4)-propanilide hydrochloride

Structural Information

Molecular Formula
C17H26N2O
SMILES
CC1CC(C(CN1C)C)CCC(=O)NC2=CC=CC=C2
InChI
InChI=1S/C17H26N2O/c1-13-12-19(3)14(2)11-15(13)9-10-17(20)18-16-7-5-4-6-8-16/h4-8,13-15H,9-12H2,1-3H3,(H,18,20)
InChIKey
KWKBMFSUUCUSRE-UHFFFAOYSA-N
Compound name
N-phenyl-3-(1,2,5-trimethylpiperidin-4-yl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

274.2045 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.21178 168.6
[M+Na]+ 297.19372 172.8
[M-H]- 273.19722 172.9
[M+NH4]+ 292.23832 183.2
[M+K]+ 313.16766 169.1
[M+H-H2O]+ 257.20176 160.0
[M+HCOO]- 319.20270 186.7
[M+CH3COO]- 333.21835 204.4
[M+Na-2H]- 295.17917 169.1
[M]+ 274.20395 165.4
[M]- 274.20505 165.4
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.