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]+ 261.196146 163.7
[M+Na]+ 283.178088 165.9
[M-H]- 259.181594 167.4
[M+NH4]+ 278.222693 178.1
[M+K]+ 299.152028 162.9
[M+H-H2O]+ 243.186130 155.3
[M+HCOO]- 305.187071 180.7
[M+CH3COO]- 319.202721 198.3
[M+Na-2H]- 281.163536 167.8
[M]+ 260.18832142 158.5
[M]- 260.18941858 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.