CID 11230995

2648938-94-5

Structural Information

Molecular Formula
C13H19NO5
SMILES
CC(C)(C)OC(=O)N1CC2(CC2)C(=O)C1C(=O)OC
InChI
InChI=1S/C13H19NO5/c1-12(2,3)19-11(17)14-7-13(5-6-13)9(15)8(14)10(16)18-4/h8H,5-7H2,1-4H3
InChIKey
ZCBRJBQSVWURKE-UHFFFAOYSA-N
Compound name
5-O-tert-butyl 6-O-methyl 7-oxo-5-azaspiro[2.4]heptane-5,6-dicarboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

269.1263 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.13358 164.4
[M+Na]+ 292.11552 173.3
[M+NH4]+ 287.16012 171.4
[M+K]+ 308.08946 172.1
[M-H]- 268.11902 169.5
[M+Na-2H]- 290.10097 169.1
[M]+ 269.12575 168.0
[M]- 269.12685 168.0
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.