CID 5337166

304896-55-7

Structural Information

Molecular Formula
C20H14Cl2O3
SMILES
COC1=CC=C(C=C1)C(=O)/C=C/C2=CC=C(O2)C3=C(C(=CC=C3)Cl)Cl
InChI
InChI=1S/C20H14Cl2O3/c1-24-14-7-5-13(6-8-14)18(23)11-9-15-10-12-19(25-15)16-3-2-4-17(21)20(16)22/h2-12H,1H3/b11-9+
InChIKey
LKBDOMDZHBNVAL-PKNBQFBNSA-N
Compound name
(E)-3-[5-(2,3-dichlorophenyl)furan-2-yl]-1-(4-methoxyphenyl)prop-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

372.032 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 373.03928 184.2
[M+Na]+ 395.02122 201.3
[M+NH4]+ 390.06582 192.6
[M+K]+ 410.99516 193.5
[M-H]- 371.02472 191.1
[M+Na-2H]- 393.00667 193.0
[M]+ 372.03145 189.5
[M]- 372.03255 189.5
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.