CID 34734

2,2,5,5-tetraethyloxolan-3-ol

Structural Information

Molecular Formula
C12H24O2
SMILES
CCC1(CC(C(O1)(CC)CC)O)CC
InChI
InChI=1S/C12H24O2/c1-5-11(6-2)9-10(13)12(7-3,8-4)14-11/h10,13H,5-9H2,1-4H3
InChIKey
NWJXHTOLDZDJGB-UHFFFAOYSA-N
Compound name
2,2,5,5-tetraethyloxolan-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

200.17763 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.184906 144.9
[M+Na]+ 223.166848 152.2
[M-H]- 199.170354 147.7
[M+NH4]+ 218.211453 168.5
[M+K]+ 239.140788 151.5
[M+H-H2O]+ 183.174890 142.0
[M+HCOO]- 245.175831 164.3
[M+CH3COO]- 259.191481 184.2
[M+Na-2H]- 221.152296 149.4
[M]+ 200.17708142 146.8
[M]- 200.17817858 146.8
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.