CID 200019

1-piperidinepropionamide, n-(p-propoxybenzyl)-, hydrochloride

Structural Information

Molecular Formula
C18H28N2O2
SMILES
CCCOC1=CC=C(C=C1)CNC(=O)CCN2CCCCC2
InChI
InChI=1S/C18H28N2O2/c1-2-14-22-17-8-6-16(7-9-17)15-19-18(21)10-13-20-11-4-3-5-12-20/h6-9H,2-5,10-15H2,1H3,(H,19,21)
InChIKey
UUSAQCHRGIZGLB-UHFFFAOYSA-N
Compound name
3-piperidin-1-yl-N-[(4-propoxyphenyl)methyl]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

304.2151 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.22238 175.8
[M+Na]+ 327.20432 177.5
[M-H]- 303.20782 179.1
[M+NH4]+ 322.24892 188.4
[M+K]+ 343.17826 174.1
[M+H-H2O]+ 287.21236 166.2
[M+HCOO]- 349.21330 193.8
[M+CH3COO]- 363.22895 207.1
[M+Na-2H]- 325.18977 177.3
[M]+ 304.21455 173.6
[M]- 304.21565 173.6
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.