CID 15342836

62507-01-1

Structural Information

Molecular Formula
C24H20O7
SMILES
COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC)OCC4=CC=CC=C4
InChI
InChI=1S/C24H20O7/c1-28-18-9-8-15(10-19(18)30-13-14-6-4-3-5-7-14)23-24(29-2)22(27)21-17(26)11-16(25)12-20(21)31-23/h3-12,25-26H,13H2,1-2H3
InChIKey
JPEXDMDZYIHQEF-UHFFFAOYSA-N
Compound name
5,7-dihydroxy-3-methoxy-2-(4-methoxy-3-phenylmethoxyphenyl)chromen-4-one
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

18
Patents

420.1209 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 421.12818 199.0
[M+Na]+ 443.11012 208.1
[M-H]- 419.11362 208.8
[M+NH4]+ 438.15472 207.2
[M+K]+ 459.08406 205.6
[M+H-H2O]+ 403.11816 188.3
[M+HCOO]- 465.11910 217.8
[M+CH3COO]- 479.13475 224.4
[M+Na-2H]- 441.09557 202.1
[M]+ 420.12035 206.2
[M]- 420.12145 206.2
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.