CID 79748

N,n-diethylallylamine

Structural Information

Molecular Formula

C₇H₁₅N

SMILES

CCN(CC)CC=C

InChI

InChI=1S/C7H15N/c1-4-7-8(5-2)6-3/h4H,1,5-7H2,2-3H3

InChIKey

JWAJUTZQGZBKFS-UHFFFAOYSA-N

Compound name

N,N-diethylprop-2-en-1-amine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 1
References: 1352
Patents: 113.12045 Da
Monoisotopic Mass: 1.6
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]+	114.12773	125.8
[M+Na]+	136.10967	136.1
[M+NH4]+	131.15427	134.5
[M+K]+	152.08361	129.8
[M-H]-	112.11317	126.8
[M+Na-2H]-	134.09512	130.6
[M]+	113.11990	127.4
[M]-	113.12100	127.4

Literature stripe

literature stripe

Patent stripe

patents stripe