CID 34728

5-ethyl-5-methyl-2-propyltetrahydro-3-furanol

Structural Information

Molecular Formula
C10H20O2
SMILES
CCCC1C(CC(O1)(C)CC)O
InChI
InChI=1S/C10H20O2/c1-4-6-9-8(11)7-10(3,5-2)12-9/h8-9,11H,4-7H2,1-3H3
InChIKey
SZMBJWBJLAVKRD-UHFFFAOYSA-N
Compound name
5-ethyl-5-methyl-2-propyloxolan-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

172.14633 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.15361 138.7
[M+Na]+ 195.13555 145.9
[M-H]- 171.13905 141.5
[M+NH4]+ 190.18015 161.4
[M+K]+ 211.10949 145.5
[M+H-H2O]+ 155.14359 135.1
[M+HCOO]- 217.14453 158.7
[M+CH3COO]- 231.16018 178.3
[M+Na-2H]- 193.12100 142.7
[M]+ 172.14578 139.5
[M]- 172.14688 139.5
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.