CID 4345612

2137818-27-8

Structural Information

Molecular Formula

C₇H₁₆N₂O₂

SMILES

CCOC(CC(=N)N)OCC

InChI

InChI=1S/C7H16N2O2/c1-3-10-7(11-4-2)5-6(8)9/h7H,3-5H2,1-2H3,(H3,8,9)

InChIKey

JILSBDSMWZMWKO-UHFFFAOYSA-N

Compound name

3,3-diethoxypropanimidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 160.12119 Da
Monoisotopic Mass: -0.2
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]+	161.12847	136.6
[M+Na]+	183.11041	143.4
[M+NH4]+	178.15501	142.9
[M+K]+	199.08435	139.9
[M-H]-	159.11391	135.6
[M+Na-2H]-	181.09586	138.5
[M]+	160.12064	136.7
[M]-	160.12174	136.7

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.