CID 164099

119123-40-9

Structural Information

Molecular Formula
C11H8Cl2O2
SMILES
C1=CC(=C(C(=C1)Cl)C(C2=CC=CO2)O)Cl
InChI
InChI=1S/C11H8Cl2O2/c12-7-3-1-4-8(13)10(7)11(14)9-5-2-6-15-9/h1-6,11,14H
InChIKey
FZGMVOSHWNKUKJ-UHFFFAOYSA-N
Compound name
(2,6-dichlorophenyl)-(furan-2-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.99013 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.99741 148.7
[M+Na]+ 264.97935 158.9
[M-H]- 240.98285 154.6
[M+NH4]+ 260.02395 167.4
[M+K]+ 280.95329 154.1
[M+H-H2O]+ 224.98739 144.3
[M+HCOO]- 286.98833 162.0
[M+CH3COO]- 301.00398 162.0
[M+Na-2H]- 262.96480 152.2
[M]+ 241.98958 152.5
[M]- 241.99068 152.5
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.