CID 166133228

{6-oxaspiro[2.5]octan-5-yl}methanol

Structural Information

Molecular Formula
C8H14O2
SMILES
C1CC12CCOC(C2)CO
InChI
InChI=1S/C8H14O2/c9-6-7-5-8(1-2-8)3-4-10-7/h7,9H,1-6H2
InChIKey
YMUMSIAIUUKGQB-UHFFFAOYSA-N
Compound name
6-oxaspiro[2.5]octan-7-ylmethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

142.09938 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.106656 130.4
[M+Na]+ 165.088598 138.2
[M-H]- 141.092104 136.2
[M+NH4]+ 160.133203 147.3
[M+K]+ 181.062538 138.4
[M+H-H2O]+ 125.096640 125.3
[M+HCOO]- 187.097581 148.9
[M+CH3COO]- 201.113231 173.0
[M+Na-2H]- 163.074046 138.7
[M]+ 142.09883142 129.8
[M]- 142.09992858 129.8
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.