CID 34711

5,5-dipropyltetrahydro-3-furanol

Structural Information

Molecular Formula
C10H20O2
SMILES
CCCC1(CC(CO1)O)CCC
InChI
InChI=1S/C10H20O2/c1-3-5-10(6-4-2)7-9(11)8-12-10/h9,11H,3-8H2,1-2H3
InChIKey
STXIKETXVNCOMR-UHFFFAOYSA-N
Compound name
5,5-dipropyloxolan-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

172.14633 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.15361 139.8
[M+Na]+ 195.13555 149.1
[M+NH4]+ 190.18015 149.3
[M+K]+ 211.10949 143.6
[M-H]- 171.13905 141.7
[M+Na-2H]- 193.12100 144.0
[M]+ 172.14578 141.6
[M]- 172.14688 141.6
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.