CID 3019910

2-butyltetrahydro-4,6-dimethyl-2h-pyran-4-ol

Structural Information

Molecular Formula
C11H22O2
SMILES
CCCCC1CC(CC(O1)C)(C)O
InChI
InChI=1S/C11H22O2/c1-4-5-6-10-8-11(3,12)7-9(2)13-10/h9-10,12H,4-8H2,1-3H3
InChIKey
GLZDYSFULFXMRT-UHFFFAOYSA-N
Compound name
2-butyl-4,6-dimethyloxan-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

186.16199 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.169266 143.4
[M+Na]+ 209.151208 149.3
[M-H]- 185.154714 146.0
[M+NH4]+ 204.195813 163.8
[M+K]+ 225.125148 149.0
[M+H-H2O]+ 169.159250 139.0
[M+HCOO]- 231.160191 161.0
[M+CH3COO]- 245.175841 181.7
[M+Na-2H]- 207.136656 148.1
[M]+ 186.16144142 142.6
[M]- 186.16253858 142.6
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.