CID 5152851

2-(isopropylamino)acetamide

Structural Information

Molecular Formula

C₅H₁₂N₂O

SMILES

CC(C)NCC(=O)N

InChI

InChI=1S/C5H12N2O/c1-4(2)7-3-5(6)8/h4,7H,3H2,1-2H3,(H2,6,8)

InChIKey

BKDSFWIFBDVZHY-UHFFFAOYSA-N

Compound name

2-(propan-2-ylamino)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 76
Patents: 116.09496 Da
Monoisotopic Mass: -0.5
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	124.9
[M+Na]+	139.08418	132.7
[M+NH4]+	134.12878	132.2
[M+K]+	155.05812	129.0
[M-H]-	115.08768	124.7
[M+Na-2H]-	137.06963	127.8
[M]+	116.09441	125.4
[M]-	116.09551	125.4

Literature stripe

literature stripe

Patent stripe

patents stripe