CID 131752306

9-methoxy-2,8-bis(3-methylbut-2-enyl)-6a,11a-dihydro-6h-[1]benzofuro[3,2-c]chromene-1,3-diol

Structural Information

Molecular Formula
C26H30O5
SMILES
CC(=CCC1=CC2=C(C=C1OC)OC3C2COC4=C3C(=C(C(=C4)O)CC=C(C)C)O)C
InChI
InChI=1S/C26H30O5/c1-14(2)6-8-16-10-18-19-13-30-23-11-20(27)17(9-7-15(3)4)25(28)24(23)26(19)31-22(18)12-21(16)29-5/h6-7,10-12,19,26-28H,8-9,13H2,1-5H3
InChIKey
YCYLVHIWXLJVIC-UHFFFAOYSA-N
Compound name
9-methoxy-2,8-bis(3-methylbut-2-enyl)-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromene-1,3-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

422.20932 Da
Monoisotopic Mass

6.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 423.216596 207.0
[M+Na]+ 445.198538 213.8
[M-H]- 421.202044 211.6
[M+NH4]+ 440.243143 218.6
[M+K]+ 461.172478 210.1
[M+H-H2O]+ 405.206580 200.8
[M+HCOO]- 467.207521 216.8
[M+CH3COO]- 481.223171 229.8
[M+Na-2H]- 443.183986 204.1
[M]+ 422.20877142 211.5
[M]- 422.20986858 211.5
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.