CID 10931381

3-aminobutanamide hydrochloride

Structural Information

Molecular Formula

C₄H₁₀N₂O

SMILES

CC(CC(=O)N)N

InChI

InChI=1S/C4H10N2O/c1-3(5)2-4(6)7/h3H,2,5H2,1H3,(H2,6,7)

InChIKey

OTVXVVYHNZUDSN-UHFFFAOYSA-N

Compound name

3-aminobutanamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 399
Patents: 102.079315 Da
Monoisotopic Mass: -1.4
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]+	103.08659	121.4
[M+Na]+	125.06853	127.5
[M-H]-	101.07204	121.0
[M+NH4]+	120.11314	143.3
[M+K]+	141.04247	127.8
[M+H-H2O]+	85.076575	116.4
[M+HCOO]-	147.07752	145.0
[M+CH3COO]-	161.09317	172.2
[M+Na-2H]-	123.05398	125.1
[M]+	102.07877	117.6
[M]-	102.07986	117.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe