CID 3065814

1-piperidinepropionanilide, beta,2-dimethyl-

Structural Information

Molecular Formula
C16H24N2O
SMILES
CC1CCCCN1C(C)CC(=O)NC2=CC=CC=C2
InChI
InChI=1S/C16H24N2O/c1-13-8-6-7-11-18(13)14(2)12-16(19)17-15-9-4-3-5-10-15/h3-5,9-10,13-14H,6-8,11-12H2,1-2H3,(H,17,19)
InChIKey
ZJMPXXSPWMRTMS-UHFFFAOYSA-N
Compound name
3-(2-methylpiperidin-1-yl)-N-phenylbutanamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

260.18887 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.196146 164.2
[M+Na]+ 283.178088 166.7
[M-H]- 259.181594 168.1
[M+NH4]+ 278.222693 178.7
[M+K]+ 299.152028 163.7
[M+H-H2O]+ 243.186130 155.5
[M+HCOO]- 305.187071 181.7
[M+CH3COO]- 319.202721 199.9
[M+Na-2H]- 281.163536 165.5
[M]+ 260.18832142 159.3
[M]- 260.18941858 159.3
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.