CID 185186

92662-85-6

Structural Information

Molecular Formula
C20H20O4
SMILES
CC(=C)C1CC2=CC(=C(C=C2O1)O)C3CC4=C(C=C(C=C4)O)OC3
InChI
InChI=1S/C20H20O4/c1-11(2)18-7-13-6-16(17(22)9-20(13)24-18)14-5-12-3-4-15(21)8-19(12)23-10-14/h3-4,6,8-9,14,18,21-22H,1,5,7,10H2,2H3
InChIKey
QSBNBPUPUBDYQE-UHFFFAOYSA-N
Compound name
3-(6-hydroxy-2-prop-1-en-2-yl-2,3-dihydro-1-benzofuran-5-yl)-3,4-dihydro-2H-chromen-7-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

324.13617 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.14345 175.6
[M+Na]+ 347.12539 182.8
[M-H]- 323.12889 182.9
[M+NH4]+ 342.16999 189.7
[M+K]+ 363.09933 179.6
[M+H-H2O]+ 307.13343 169.4
[M+HCOO]- 369.13437 188.8
[M+CH3COO]- 383.15002 186.1
[M+Na-2H]- 345.11084 176.7
[M]+ 324.13562 174.9
[M]- 324.13672 174.9
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.