CID 76223581

L-2-amino-3-methylenehexanoic acid

Structural Information

Molecular Formula

C₇H₁₃NO₂

SMILES

CCCC(=C)C(C(=O)O)N

InChI

InChI=1S/C7H13NO2/c1-3-4-5(2)6(8)7(9)10/h6H,2-4,8H2,1H3,(H,9,10)

InChIKey

ZJMPUKNPMYTOOX-UHFFFAOYSA-N

Compound name

2-amino-3-methylidenehexanoic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 143.09464 Da
Monoisotopic Mass: -1.0
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]+	144.10192	132.8
[M+Na]+	166.08386	140.1
[M+NH4]+	161.12846	138.9
[M+K]+	182.05780	137.1
[M-H]-	142.08736	130.7
[M+Na-2H]-	164.06931	133.9
[M]+	143.09409	132.6
[M]-	143.09519	132.6

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.