CID 34734

2,2,5,5-tetraethyltetrahydro-3-furanol

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]+ 201.18491 144.9
[M+Na]+ 223.16685 152.2
[M-H]- 199.17035 147.7
[M+NH4]+ 218.21145 168.5
[M+K]+ 239.14079 151.5
[M+H-H2O]+ 183.17489 142.0
[M+HCOO]- 245.17583 164.3
[M+CH3COO]- 259.19148 184.2
[M+Na-2H]- 221.15230 149.4
[M]+ 200.17708 146.8
[M]- 200.17818 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.