CID 16793555

3-amino-n,n-diethylpropanamide

Structural Information

Molecular Formula

C₇H₁₆N₂O

SMILES

CCN(CC)C(=O)CCN

InChI

InChI=1S/C7H16N2O/c1-3-9(4-2)7(10)5-6-8/h3-6,8H2,1-2H3

InChIKey

PWFPMYPZAVNQQK-UHFFFAOYSA-N

Compound name

3-amino-N,N-diethylpropanamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 61
Patents: 144.12627 Da
Monoisotopic Mass: -0.6
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]+	145.13355	134.5
[M+Na]+	167.11549	139.9
[M-H]-	143.11899	135.6
[M+NH4]+	162.16009	155.8
[M+K]+	183.08943	140.7
[M+H-H2O]+	127.12353	128.8
[M+HCOO]-	189.12447	159.3
[M+CH3COO]-	203.14012	183.9
[M+Na-2H]-	165.10094	138.2
[M]+	144.12572	134.7
[M]-	144.12682	134.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe