CID 13793775

2-furanmethanol, 5-(ethoxymethyl)-

Structural Information

Molecular Formula
C8H12O3
SMILES
CCOCC1=CC=C(O1)CO
InChI
InChI=1S/C8H12O3/c1-2-10-6-8-4-3-7(5-9)11-8/h3-4,9H,2,5-6H2,1H3
InChIKey
PWKAMVGLPNBYPI-UHFFFAOYSA-N
Compound name
[5-(ethoxymethyl)furan-2-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

77
Patents

156.07864 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.08592 130.9
[M+Na]+ 179.06786 139.1
[M-H]- 155.07136 134.0
[M+NH4]+ 174.11246 151.9
[M+K]+ 195.04180 139.1
[M+H-H2O]+ 139.07590 126.0
[M+HCOO]- 201.07684 154.7
[M+CH3COO]- 215.09249 172.8
[M+Na-2H]- 177.05331 137.2
[M]+ 156.07809 134.5
[M]- 156.07919 134.5
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.