CID 84819129

2639408-03-8

Structural Information

Molecular Formula

C₇H₁₃NO₂

SMILES

CC1(CC1)CC(C(=O)O)N

InChI

InChI=1S/C7H13NO2/c1-7(2-3-7)4-5(8)6(9)10/h5H,2-4,8H2,1H3,(H,9,10)

InChIKey

GXUBADBLASILKZ-UHFFFAOYSA-N

Compound name

2-amino-3-(1-methylcyclopropyl)propanoic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 143.09464 Da
Monoisotopic Mass: -1.5
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	132.1
[M+Na]+	166.08386	141.7
[M+NH4]+	161.12846	141.1
[M+K]+	182.05780	138.0
[M-H]-	142.08736	139.0
[M+Na-2H]-	164.06931	139.3
[M]+	143.09409	136.3
[M]-	143.09519	136.3

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.