CID 14739

Piperamide maleate

Structural Information

Molecular Formula

C₁₇H₂₈N₄O

SMILES

CC(=O)NC1=CC=C(C=C1)N2CCN(CC2)CCCN(C)C

InChI

InChI=1S/C17H28N4O/c1-15(22)18-16-5-7-17(8-6-16)21-13-11-20(12-14-21)10-4-9-19(2)3/h5-8H,4,9-14H2,1-3H3,(H,18,22)

InChIKey

DPCSPGOPQYRPCP-UHFFFAOYSA-N

Compound name

N-[4-[4-[3-(dimethylamino)propyl]piperazin-1-yl]phenyl]acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 602
Patents: 304.22632 Da
Monoisotopic Mass: 1.4
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]+	305.23360	176.5
[M+Na]+	327.21554	179.0
[M-H]-	303.21904	180.4
[M+NH4]+	322.26014	188.4
[M+K]+	343.18948	176.4
[M+H-H2O]+	287.22358	166.1
[M+HCOO]-	349.22452	194.8
[M+CH3COO]-	363.24017	214.4
[M+Na-2H]-	325.20099	177.7
[M]+	304.22577	174.0
[M]-	304.22687	174.0

Literature stripe

literature stripe

Patent stripe

patents stripe