CID 71757071

4-oxaspiro[bicyclo[3.2.0]heptane-6,1'-cyclopentane]-7-ol

Structural Information

Molecular Formula
C10H16O2
SMILES
C1CCC2(C1)C(C3C2OCC3)O
InChI
InChI=1S/C10H16O2/c11-8-7-3-6-12-9(7)10(8)4-1-2-5-10/h7-9,11H,1-6H2
InChIKey
JGZUJPCFJQYINE-UHFFFAOYSA-N
Compound name
spiro[2-oxabicyclo[3.2.0]heptane-7,1'-cyclopentane]-6-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

168.11504 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.12232 129.5
[M+Na]+ 191.10426 134.9
[M-H]- 167.10776 135.4
[M+NH4]+ 186.14886 148.4
[M+K]+ 207.07820 136.4
[M+H-H2O]+ 151.11230 122.4
[M+HCOO]- 213.11324 147.2
[M+CH3COO]- 227.12889 177.6
[M+Na-2H]- 189.08971 134.0
[M]+ 168.11449 134.8
[M]- 168.11559 134.8
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.