CID 129950647

Tert-butyl 3-oxo-6-oxa-9-azaspiro[4.5]decane-9-carboxylate

Structural Information

Molecular Formula
C13H21NO4
SMILES
CC(C)(C)OC(=O)N1CCOC2(C1)CCC(=O)C2
InChI
InChI=1S/C13H21NO4/c1-12(2,3)18-11(16)14-6-7-17-13(9-14)5-4-10(15)8-13/h4-9H2,1-3H3
InChIKey
OEEGZBSURHJWLA-UHFFFAOYSA-N
Compound name
tert-butyl 3-oxo-6-oxa-9-azaspiro[4.5]decane-9-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

255.14706 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.154336 158.4
[M+Na]+ 278.136278 163.6
[M-H]- 254.139784 162.6
[M+NH4]+ 273.180883 176.8
[M+K]+ 294.110218 164.0
[M+H-H2O]+ 238.144320 153.1
[M+HCOO]- 300.145261 173.1
[M+CH3COO]- 314.160911 190.2
[M+Na-2H]- 276.121726 161.7
[M]+ 255.14651142 156.5
[M]- 255.14760858 156.5
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.