CID 204435

N-(alpha-(1-methyl-1-piperidino-1-ethyl)benzylidene)propionamide monohydrochloride

Structural Information

Molecular Formula
C18H26N2O
SMILES
CCC(=O)N=C(C1=CC=CC=C1)C(C)(C)N2CCCCC2
InChI
InChI=1S/C18H26N2O/c1-4-16(21)19-17(15-11-7-5-8-12-15)18(2,3)20-13-9-6-10-14-20/h5,7-8,11-12H,4,6,9-10,13-14H2,1-3H3
InChIKey
DYAHOLYBFXBNQR-UHFFFAOYSA-N
Compound name
N-(2-methyl-1-phenyl-2-piperidin-1-ylpropylidene)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

286.2045 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.21178 171.2
[M+Na]+ 309.19372 173.1
[M-H]- 285.19722 176.1
[M+NH4]+ 304.23832 185.2
[M+K]+ 325.16766 170.4
[M+H-H2O]+ 269.20176 162.4
[M+HCOO]- 331.20270 188.2
[M+CH3COO]- 345.21835 206.2
[M+Na-2H]- 307.17917 173.5
[M]+ 286.20395 167.2
[M]- 286.20505 167.2
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

No patent data available for this compound.