CID 13454827

1236266-73-1

Structural Information

Molecular Formula

C₆H₁₄N₂O

SMILES

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

InChI

InChI=1S/C6H14N2O/c1-4(2)8-6(9)5(3)7/h4-5H,7H2,1-3H3,(H,8,9)

InChIKey

QIVCLSJTIRCGKW-UHFFFAOYSA-N

Compound name

2-amino-N-propan-2-ylpropanamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 63
Patents: 130.11061 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]+	131.117886	131.1
[M+Na]+	153.099828	136.2
[M-H]-	129.103334	131.0
[M+NH4]+	148.144433	152.2
[M+K]+	169.073768	136.8
[M+H-H2O]+	113.107870	125.9
[M+HCOO]-	175.108811	153.7
[M+CH3COO]-	189.124461	179.2
[M+Na-2H]-	151.085276	133.5
[M]+	130.11006142	128.3
[M]-	130.11115858	128.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe