CID 20808

2-furyl p-hydroxyphenyl ketone

Structural Information

Molecular Formula
C11H8O3
SMILES
C1=COC(=C1)C(=O)C2=CC=C(C=C2)O
InChI
InChI=1S/C11H8O3/c12-9-5-3-8(4-6-9)11(13)10-2-1-7-14-10/h1-7,12H
InChIKey
QHNHAPUTAWUKLA-UHFFFAOYSA-N
Compound name
furan-2-yl-(4-hydroxyphenyl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

217
Patents

188.04735 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.05463 136.8
[M+Na]+ 211.03657 145.1
[M-H]- 187.04007 143.5
[M+NH4]+ 206.08117 156.0
[M+K]+ 227.01051 143.7
[M+H-H2O]+ 171.04461 131.0
[M+HCOO]- 233.04555 160.5
[M+CH3COO]- 247.06120 177.6
[M+Na-2H]- 209.02202 142.6
[M]+ 188.04680 137.8
[M]- 188.04790 137.8
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

patents stripe