CID 15726099

5-o-methylhoslundin

Structural Information

Molecular Formula
C24H20O7
SMILES
CC1=C(C(=O)C(=CO1)C2=C(C=C3C(=C2OC)C(=O)C=C(O3)C4=CC=CC=C4)OC)OC
InChI
InChI=1S/C24H20O7/c1-13-23(28-3)22(26)15(12-30-13)20-18(27-2)11-19-21(24(20)29-4)16(25)10-17(31-19)14-8-6-5-7-9-14/h5-12H,1-4H3
InChIKey
YZMKUGIAIUCXMP-UHFFFAOYSA-N
Compound name
5,7-dimethoxy-6-(5-methoxy-6-methyl-4-oxopyran-3-yl)-2-phenylchromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

420.1209 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 421.12818 200.1
[M+Na]+ 443.11012 211.7
[M-H]- 419.11362 213.8
[M+NH4]+ 438.15472 208.9
[M+K]+ 459.08406 211.2
[M+H-H2O]+ 403.11816 189.1
[M+HCOO]- 465.11910 221.2
[M+CH3COO]- 479.13475 229.9
[M+Na-2H]- 441.09557 203.7
[M]+ 420.12035 211.2
[M]- 420.12145 211.2
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

No patent data available for this compound.