CID 59256380

1260092-46-3

Structural Information

Molecular Formula

C₉H₁₉NO₃

SMILES

CC(C)(C)OC(=O)CCOCCN

InChI

InChI=1S/C9H19NO3/c1-9(2,3)13-8(11)4-6-12-7-5-10/h4-7,10H2,1-3H3

InChIKey

NSCCYXHEZRMPPH-UHFFFAOYSA-N

Compound name

tert-butyl 3-(2-aminoethoxy)propanoate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 194
Patents: 189.13649 Da
Monoisotopic Mass: -0.1
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]+	190.14377	144.0
[M+Na]+	212.12571	151.4
[M+NH4]+	207.17031	149.9
[M+K]+	228.09965	148.0
[M-H]-	188.12921	141.9
[M+Na-2H]-	210.11116	145.6
[M]+	189.13594	144.1
[M]-	189.13704	144.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe