CID 9793773

40963-14-2

Structural Information

Molecular Formula

C₆H₁₄N₂O

SMILES

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

InChI

InChI=1S/C6H14N2O/c1-4(2)6(3,8)5(7)9/h4H,8H2,1-3H3,(H2,7,9)

InChIKey

YCPQUHCGFDFLSI-UHFFFAOYSA-N

Compound name

2-amino-2,3-dimethylbutanamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 4
References: 384
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	129.7
[M+Na]+	153.099828	135.5
[M-H]-	129.103334	129.3
[M+NH4]+	148.144433	150.6
[M+K]+	169.073768	135.7
[M+H-H2O]+	113.107870	125.2
[M+HCOO]-	175.108811	151.1
[M+CH3COO]-	189.124461	178.6
[M+Na-2H]-	151.085276	133.1
[M]+	130.11006142	126.1
[M]-	130.11115858	126.1

Literature stripe

literature stripe

Patent stripe

patents stripe