CID 3065813

1-piperidinepropionanilide, beta,beta-dimethyl-

Structural Information

Molecular Formula
C16H24N2O
SMILES
CC(C)(CC(=O)NC1=CC=CC=C1)N2CCCCC2
InChI
InChI=1S/C16H24N2O/c1-16(2,18-11-7-4-8-12-18)13-15(19)17-14-9-5-3-6-10-14/h3,5-6,9-10H,4,7-8,11-13H2,1-2H3,(H,17,19)
InChIKey
SXYQZQUQFXORGD-UHFFFAOYSA-N
Compound name
3-methyl-N-phenyl-3-piperidin-1-ylbutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

260.18887 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.19615 163.7
[M+Na]+ 283.17809 165.9
[M-H]- 259.18159 167.4
[M+NH4]+ 278.22269 178.1
[M+K]+ 299.15203 162.9
[M+H-H2O]+ 243.18613 155.3
[M+HCOO]- 305.18707 180.7
[M+CH3COO]- 319.20272 198.3
[M+Na-2H]- 281.16354 167.8
[M]+ 260.18832 158.5
[M]- 260.18942 158.5
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.