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]+ 143.10666 130.4
[M+Na]+ 165.08860 138.2
[M-H]- 141.09210 136.2
[M+NH4]+ 160.13320 147.3
[M+K]+ 181.06254 138.4
[M+H-H2O]+ 125.09664 125.3
[M+HCOO]- 187.09758 148.9
[M+CH3COO]- 201.11323 173.0
[M+Na-2H]- 163.07405 138.7
[M]+ 142.09883 129.8
[M]- 142.09993 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.