CID 15405193

3-amino-3-methylbutanamide hydrochloride

Structural Information

Molecular Formula

C₅H₁₂N₂O

SMILES

CC(C)(CC(=O)N)N

InChI

InChI=1S/C5H12N2O/c1-5(2,7)3-4(6)8/h3,7H2,1-2H3,(H2,6,8)

InChIKey

BQVGZFQLSSJSMW-UHFFFAOYSA-N

Compound name

3-amino-3-methylbutanamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 99
Patents: 116.09496 Da
Monoisotopic Mass: -1.2
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]+	117.10224	124.4
[M+Na]+	139.08418	131.9
[M+NH4]+	134.12878	131.4
[M+K]+	155.05812	129.0
[M-H]-	115.08768	123.5
[M+Na-2H]-	137.06963	127.1
[M]+	116.09441	124.8
[M]-	116.09551	124.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe