CID 50989096

Methyl 2-(cyclopropylamino)propanoate

Structural Information

Molecular Formula

C₇H₁₃NO₂

SMILES

CC(C(=O)OC)NC1CC1

InChI

InChI=1S/C7H13NO2/c1-5(7(9)10-2)8-6-3-4-6/h5-6,8H,3-4H2,1-2H3

InChIKey

HAOGZMWLQGAHRX-UHFFFAOYSA-N

Compound name

methyl 2-(cyclopropylamino)propanoate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 143.09464 Da
Monoisotopic Mass: 0.7
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]+	144.101916	130.3
[M+Na]+	166.083858	138.1
[M-H]-	142.087364	135.0
[M+NH4]+	161.128463	146.7
[M+K]+	182.057798	137.1
[M+H-H2O]+	126.091900	124.4
[M+HCOO]-	188.092841	153.9
[M+CH3COO]-	202.108491	180.9
[M+Na-2H]-	164.069306	135.3
[M]+	143.09409142	133.2
[M]-	143.09518858	133.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe