CID 121207792

173203-63-9

Structural Information

Molecular Formula
C8H14O2
SMILES
C1CC12CC(C2)(CO)CO
InChI
InChI=1S/C8H14O2/c9-5-8(6-10)3-7(4-8)1-2-7/h9-10H,1-6H2
InChIKey
HKRJRXMNHKISEI-UHFFFAOYSA-N
Compound name
[5-(hydroxymethyl)spiro[2.3]hexan-5-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

142.09938 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.106656 130.7
[M+Na]+ 165.088598 138.8
[M-H]- 141.092104 135.4
[M+NH4]+ 160.133203 144.3
[M+K]+ 181.062538 140.0
[M+H-H2O]+ 125.096640 123.8
[M+HCOO]- 187.097581 149.4
[M+CH3COO]- 201.113231 175.6
[M+Na-2H]- 163.074046 138.7
[M]+ 142.09883142 140.3
[M]- 142.09992858 140.3
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.