CID 8523

Phenampromide

Structural Information

Molecular Formula

C₁₇H₂₆N₂O

SMILES

CCC(=O)N(C1=CC=CC=C1)C(C)CN2CCCCC2

InChI

InChI=1S/C17H26N2O/c1-3-17(20)19(16-10-6-4-7-11-16)15(2)14-18-12-8-5-9-13-18/h4,6-7,10-11,15H,3,5,8-9,12-14H2,1-2H3

InChIKey

DHTRHEVNFFZCNU-UHFFFAOYSA-N

Compound name

N-phenyl-N-(1-piperidin-1-ylpropan-2-yl)propanamide

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 0
References: 572
Patents: 274.2045 Da
Monoisotopic Mass: 3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	275.21178	168.7
[M+Na]+	297.19372	169.8
[M-H]-	273.19722	173.3
[M+NH4]+	292.23832	182.8
[M+K]+	313.16766	167.9
[M+H-H2O]+	257.20176	159.3
[M+HCOO]-	319.20270	186.3
[M+CH3COO]-	333.21835	205.2
[M+Na-2H]-	295.17917	169.4
[M]+	274.20395	164.9
[M]-	274.20505	164.9

Literature stripe

literature stripe

Patent stripe

patents stripe