CID 73977868

1367777-12-5

Structural Information

Molecular Formula

C₁₁H₂₀N₂O₃

SMILES

CC(C)(C)OC(=O)N1CCNC2(C1)COC2

InChI

InChI=1S/C11H20N2O3/c1-10(2,3)16-9(14)13-5-4-12-11(6-13)7-15-8-11/h12H,4-8H2,1-3H3

InChIKey

YUSLKABKYBSTRL-UHFFFAOYSA-N

Compound name

tert-butyl 2-oxa-5,8-diazaspiro[3.5]nonane-8-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 58
Patents: 228.1474 Da
Monoisotopic Mass: 0.0
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]+	229.15468	154.7
[M+Na]+	251.13662	158.6
[M+NH4]+	246.18122	158.0
[M+K]+	267.11056	155.7
[M-H]-	227.14012	152.1
[M+Na-2H]-	249.12207	155.6
[M]+	228.14685	153.1
[M]-	228.14795	153.1

Literature stripe

literature stripe

Patent stripe

patents stripe