CID 132398535

2166932-74-5

Structural Information

Molecular Formula
C9H14O2
SMILES
C1CC2(C1)C3(CC3CO2)CO
InChI
InChI=1S/C9H14O2/c10-6-8-4-7(8)5-11-9(8)2-1-3-9/h7,10H,1-6H2
InChIKey
YLXQVACQLCONDX-UHFFFAOYSA-N
Compound name
spiro[3-oxabicyclo[3.1.0]hexane-2,1'-cyclobutane]-1-ylmethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

154.09938 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.106656 128.5
[M+Na]+ 177.088598 136.9
[M-H]- 153.092104 135.5
[M+NH4]+ 172.133203 143.5
[M+K]+ 193.062538 139.0
[M+H-H2O]+ 137.096640 121.7
[M+HCOO]- 199.097581 146.1
[M+CH3COO]- 213.113231 178.7
[M+Na-2H]- 175.074046 137.2
[M]+ 154.09883142 138.8
[M]- 154.09992858 138.8
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.