CID 2777439

Methyl 2-(tert-butylamino)acetate

Structural Information

Molecular Formula

C₇H₁₅NO₂

SMILES

CC(C)(C)NCC(=O)OC

InChI

InChI=1S/C7H15NO2/c1-7(2,3)8-5-6(9)10-4/h8H,5H2,1-4H3

InChIKey

CYEJIYSGYKMEHD-UHFFFAOYSA-N

Compound name

methyl 2-(tert-butylamino)acetate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 96
Patents: 145.11028 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]+	146.11756	132.5
[M+Na]+	168.09950	141.1
[M+NH4]+	163.14410	139.5
[M+K]+	184.07344	137.3
[M-H]-	144.10300	131.2
[M+Na-2H]-	166.08495	135.5
[M]+	145.10973	133.1
[M]-	145.11083	133.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe