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]+ 256.154336 151.4
[M+Na]+ 278.136278 153.9
[M-H]- 254.139784 156.6
[M+NH4]+ 273.180883 160.8
[M+K]+ 294.110218 160.2
[M+H-H2O]+ 238.144320 142.1
[M+HCOO]- 300.145261 164.7
[M+CH3COO]- 314.160911 196.2
[M+Na-2H]- 276.121726 155.8
[M]+ 255.14651142 156.2
[M]- 255.14760858 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.