CID 122163682

Tert-butyl 8-hydroxy-5-azaspiro[3.4]octane-5-carboxylate

Structural Information

Molecular Formula
C12H21NO3
SMILES
CC(C)(C)OC(=O)N1CCC(C12CCC2)O
InChI
InChI=1S/C12H21NO3/c1-11(2,3)16-10(15)13-8-5-9(14)12(13)6-4-7-12/h9,14H,4-8H2,1-3H3
InChIKey
HGNCHMUMZPIMGE-UHFFFAOYSA-N
Compound name
tert-butyl 8-hydroxy-5-azaspiro[3.4]octane-5-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

227.15215 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.15943 153.1
[M+Na]+ 250.14137 157.5
[M-H]- 226.14487 155.9
[M+NH4]+ 245.18597 167.0
[M+K]+ 266.11531 159.3
[M+H-H2O]+ 210.14941 143.9
[M+HCOO]- 272.15035 168.2
[M+CH3COO]- 286.16600 188.0
[M+Na-2H]- 248.12682 155.4
[M]+ 227.15160 160.0
[M]- 227.15270 160.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.