CID 55290909

2-cyano-2-methylbutanamide

Structural Information

Molecular Formula

C₆H₁₀N₂O

SMILES

CCC(C)(C#N)C(=O)N

InChI

InChI=1S/C6H10N2O/c1-3-6(2,4-7)5(8)9/h3H2,1-2H3,(H2,8,9)

InChIKey

UYTSIEFPLLPNDU-UHFFFAOYSA-N

Compound name

2-cyano-2-methylbutanamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 126.079315 Da
Monoisotopic Mass: 0.3
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]+	127.08659	128.8
[M+Na]+	149.06853	137.2
[M+NH4]+	144.11314	132.5
[M+K]+	165.04247	130.5
[M-H]-	125.07204	120.7
[M+Na-2H]-	147.05398	129.7
[M]+	126.07877	126.6
[M]-	126.07986	126.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe