CID 22744549

240401-09-6

Structural Information

Molecular Formula
C13H23NO4
SMILES
CC(C)(C)OC(=O)N1CCC2(CC1)CC(CO2)O
InChI
InChI=1S/C13H23NO4/c1-12(2,3)18-11(16)14-6-4-13(5-7-14)8-10(15)9-17-13/h10,15H,4-9H2,1-3H3
InChIKey
HCDWHGFENXBNSC-UHFFFAOYSA-N
Compound name
tert-butyl 3-hydroxy-1-oxa-8-azaspiro[4.5]decane-8-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

108
Patents

257.16272 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.17000 160.5
[M+Na]+ 280.15194 164.9
[M-H]- 256.15544 163.2
[M+NH4]+ 275.19654 178.1
[M+K]+ 296.12588 165.0
[M+H-H2O]+ 240.15998 155.3
[M+HCOO]- 302.16092 173.4
[M+CH3COO]- 316.17657 188.6
[M+Na-2H]- 278.13739 163.3
[M]+ 257.16217 157.4
[M]- 257.16327 157.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe