CID 129950630

1251006-25-3

Structural Information

Molecular Formula
C13H21NO4
SMILES
CC(C)(C)OC(=O)N1CCOCC2(C1)CC(=O)C2
InChI
InChI=1S/C13H21NO4/c1-12(2,3)18-11(16)14-4-5-17-9-13(8-14)6-10(15)7-13/h4-9H2,1-3H3
InChIKey
NKDUIIIEUXPHNI-UHFFFAOYSA-N
Compound name
tert-butyl 2-oxo-6-oxa-9-azaspiro[3.6]decane-9-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

255.14706 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.15434 151.4
[M+Na]+ 278.13628 153.9
[M-H]- 254.13978 156.6
[M+NH4]+ 273.18088 160.8
[M+K]+ 294.11022 160.2
[M+H-H2O]+ 238.14432 142.1
[M+HCOO]- 300.14526 164.7
[M+CH3COO]- 314.16091 196.2
[M+Na-2H]- 276.12173 155.8
[M]+ 255.14651 156.2
[M]- 255.14761 156.2
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.