CID 55255057

2,2-diethoxypropan-1-amine

Structural Information

Molecular Formula

C₇H₁₇NO₂

SMILES

CCOC(C)(CN)OCC

InChI

InChI=1S/C7H17NO2/c1-4-9-7(3,6-8)10-5-2/h4-6,8H2,1-3H3

InChIKey

UINLQSAHXLBLRS-UHFFFAOYSA-N

Compound name

2,2-diethoxypropan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 23
Patents: 147.12593 Da
Monoisotopic Mass: 0.1
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]+	148.13321	132.6
[M+Na]+	170.11515	141.1
[M+NH4]+	165.15975	139.8
[M+K]+	186.08909	136.9
[M-H]-	146.11865	131.5
[M+Na-2H]-	168.10060	135.7
[M]+	147.12538	133.2
[M]-	147.12648	133.2

Literature stripe

literature stripe

Patent stripe

patents stripe