CID 676293

6,3'-dimethoxyflavone

Structural Information

Molecular Formula
C17H14O4
SMILES
COC1=CC2=C(C=C1)OC(=CC2=O)C3=CC(=CC=C3)OC
InChI
InChI=1S/C17H14O4/c1-19-12-5-3-4-11(8-12)17-10-15(18)14-9-13(20-2)6-7-16(14)21-17/h3-10H,1-2H3
InChIKey
LLLIKVGWTVPYAL-UHFFFAOYSA-N
Compound name
6-methoxy-2-(3-methoxyphenyl)chromen-4-one
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

5
References

72
Patents

282.0892 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.09648 161.2
[M+Na]+ 305.07842 171.7
[M-H]- 281.08192 170.5
[M+NH4]+ 300.12302 177.1
[M+K]+ 321.05236 169.5
[M+H-H2O]+ 265.08646 153.0
[M+HCOO]- 327.08740 184.3
[M+CH3COO]- 341.10305 201.1
[M+Na-2H]- 303.06387 168.7
[M]+ 282.08865 167.2
[M]- 282.08975 167.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe