CID 102103428

1250998-24-3

Structural Information

Molecular Formula

C₁₁H₂₀N₂O₃

SMILES

CC(C)(C)OC(=O)N1CC2(C1)CC(CO2)N

InChI

InChI=1S/C11H20N2O3/c1-10(2,3)16-9(14)13-6-11(7-13)4-8(12)5-15-11/h8H,4-7,12H2,1-3H3

InChIKey

DJQMEIQMZYMIIH-UHFFFAOYSA-N

Compound name

tert-butyl 7-amino-5-oxa-2-azaspiro[3.4]octane-2-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 228.1474 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]+	229.154676	151.1
[M+Na]+	251.136618	155.2
[M-H]-	227.140124	155.3
[M+NH4]+	246.181223	163.7
[M+K]+	267.110558	158.8
[M+H-H2O]+	211.144660	141.2
[M+HCOO]-	273.145601	167.3
[M+CH3COO]-	287.161251	191.8
[M+Na-2H]-	249.122066	154.6
[M]+	228.14685142	158.2
[M]-	228.14794858	158.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe