CID 71306096

1330763-29-5

Structural Information

Molecular Formula

C₁₀H₂₀N₂O₃

SMILES

CC(C)(C)OC(=O)N1CC(C1)(CCN)O

InChI

InChI=1S/C10H20N2O3/c1-9(2,3)15-8(13)12-6-10(14,7-12)4-5-11/h14H,4-7,11H2,1-3H3

InChIKey

QSXRCDIVJJJTIH-UHFFFAOYSA-N

Compound name

tert-butyl 3-(2-aminoethyl)-3-hydroxyazetidine-1-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 8
Patents: 216.1474 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]+	217.15468	155.1
[M+Na]+	239.13662	157.6
[M+NH4]+	234.18122	157.6
[M+K]+	255.11056	155.1
[M-H]-	215.14012	150.4
[M+Na-2H]-	237.12207	155.2
[M]+	216.14685	152.7
[M]-	216.14795	152.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe