CID 118728

34745-96-5

Structural Information

Molecular Formula

C₉H₂₂N₂O

SMILES

CN(C)CCCOCCN(C)C

InChI

InChI=1S/C9H22N2O/c1-10(2)6-5-8-12-9-7-11(3)4/h5-9H2,1-4H3

InChIKey

QEOGKTCJGDHZDW-UHFFFAOYSA-N

Compound name

3-[2-(dimethylamino)ethoxy]-N,N-dimethylpropan-1-amine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 393
Patents: 174.17322 Da
Monoisotopic Mass: 0.5
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]+	175.18050	144.2
[M+Na]+	197.16244	148.8
[M-H]-	173.16594	146.8
[M+NH4]+	192.20704	165.4
[M+K]+	213.13638	151.0
[M+H-H2O]+	157.17048	137.8
[M+HCOO]-	219.17142	170.3
[M+CH3COO]-	233.18707	195.1
[M+Na-2H]-	195.14789	148.5
[M]+	174.17267	149.0
[M]-	174.17377	149.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe