CID 24840729

7-oxa-9-azaspiro(4.5)decane-8,10-dione

Structural Information

Molecular Formula
C8H11NO3
SMILES
C1CCC2(C1)COC(=O)NC2=O
InChI
InChI=1S/C8H11NO3/c10-6-8(3-1-2-4-8)5-12-7(11)9-6/h1-5H2,(H,9,10,11)
InChIKey
PHPJKYHMPCUZFL-UHFFFAOYSA-N
Compound name
7-oxa-9-azaspiro[4.5]decane-8,10-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.0739 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.081176 134.0
[M+Na]+ 192.063118 140.6
[M-H]- 168.066624 137.1
[M+NH4]+ 187.107723 154.8
[M+K]+ 208.037058 139.6
[M+H-H2O]+ 152.071160 128.6
[M+HCOO]- 214.072101 151.1
[M+CH3COO]- 228.087751 171.2
[M+Na-2H]- 190.048566 139.2
[M]+ 169.07335142 128.2
[M]- 169.07444858 128.2
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.