CID 3088266

Alpha-(4-fluorophenyl)-7-methoxy-2-benzofuranmethanol

Structural Information

Molecular Formula
C16H13FO3
SMILES
COC1=CC=CC2=C1OC(=C2)C(C3=CC=C(C=C3)F)O
InChI
InChI=1S/C16H13FO3/c1-19-13-4-2-3-11-9-14(20-16(11)13)15(18)10-5-7-12(17)8-6-10/h2-9,15,18H,1H3
InChIKey
KCCYXGIIXDJCOU-UHFFFAOYSA-N
Compound name
(4-fluorophenyl)-(7-methoxy-1-benzofuran-2-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

272.08487 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.09215 160.1
[M+Na]+ 295.07409 174.6
[M+NH4]+ 290.11869 168.3
[M+K]+ 311.04803 169.5
[M-H]- 271.07759 164.2
[M+Na-2H]- 293.05954 167.2
[M]+ 272.08432 163.4
[M]- 272.08542 163.4
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.