CID 137949346

6-hydroxyspiro[4.5]decan-8-one

Structural Information

Molecular Formula
C10H16O2
SMILES
C1CCC2(C1)CCC(=O)CC2O
InChI
InChI=1S/C10H16O2/c11-8-3-6-10(9(12)7-8)4-1-2-5-10/h9,12H,1-7H2
InChIKey
AEFKYSSOEHPNEE-UHFFFAOYSA-N
Compound name
10-hydroxyspiro[4.5]decan-8-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

168.11504 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.12232 138.2
[M+Na]+ 191.10426 143.7
[M-H]- 167.10776 141.9
[M+NH4]+ 186.14886 161.8
[M+K]+ 207.07820 141.3
[M+H-H2O]+ 151.11230 133.5
[M+HCOO]- 213.11324 156.5
[M+CH3COO]- 227.12889 173.3
[M+Na-2H]- 189.08971 141.4
[M]+ 168.11449 131.1
[M]- 168.11559 131.1
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.