CID 23390375

[2-(2-aminoethoxy)ethyl](propan-2-yl)amine

Structural Information

Molecular Formula

C₇H₁₈N₂O

SMILES

CC(C)NCCOCCN

InChI

InChI=1S/C7H18N2O/c1-7(2)9-4-6-10-5-3-8/h7,9H,3-6,8H2,1-2H3

InChIKey

FRKZWCMEYFKGNM-UHFFFAOYSA-N

Compound name

N-[2-(2-aminoethoxy)ethyl]propan-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 13
Patents: 146.1419 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]+	147.149176	135.3
[M+Na]+	169.131118	140.1
[M-H]-	145.134624	134.8
[M+NH4]+	164.175723	155.9
[M+K]+	185.105058	140.1
[M+H-H2O]+	129.139160	129.6
[M+HCOO]-	191.140101	159.4
[M+CH3COO]-	205.155751	182.1
[M+Na-2H]-	167.116566	139.8
[M]+	146.14135142	135.0
[M]-	146.14244858	135.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe