CID 61831593

2-(aminomethyl)-2-ethylbutanamide

Structural Information

Molecular Formula

C₇H₁₆N₂O

SMILES

CCC(CC)(CN)C(=O)N

InChI

InChI=1S/C7H16N2O/c1-3-7(4-2,5-8)6(9)10/h3-5,8H2,1-2H3,(H2,9,10)

InChIKey

SFVSJNBBGAERAG-UHFFFAOYSA-N

Compound name

2-(aminomethyl)-2-ethylbutanamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 144.12627 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]+	145.13355	133.2
[M+Na]+	167.11549	140.3
[M+NH4]+	162.16009	139.8
[M+K]+	183.08943	136.9
[M-H]-	143.11899	132.2
[M+Na-2H]-	165.10094	135.4
[M]+	144.12572	133.5
[M]-	144.12682	133.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe