CID 66782779

1101840-72-5

Structural Information

Molecular Formula

C₁₂H₂₁NO₃

SMILES

CC(C)(C)OC(=O)N1CCC2(CC2)C(C1)O

InChI

InChI=1S/C12H21NO3/c1-11(2,3)16-10(15)13-7-6-12(4-5-12)9(14)8-13/h9,14H,4-8H2,1-3H3

InChIKey

MQOLTEHTFKRZNV-UHFFFAOYSA-N

Compound name

tert-butyl 8-hydroxy-6-azaspiro[2.5]octane-6-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 40
Patents: 227.15215 Da
Monoisotopic Mass: 1.2
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]+	228.15943	156.3
[M+Na]+	250.14137	166.6
[M+NH4]+	245.18597	165.0
[M+K]+	266.11531	162.3
[M-H]-	226.14487	163.2
[M+Na-2H]-	248.12682	163.0
[M]+	227.15160	160.8
[M]-	227.15270	160.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe