CID 13889540

1,2,4,8-tetraacetoxy-7-hydroxy-3-(4-hydroxyphenyl)dibenzofuran

Structural Information

Molecular Formula
C26H20O11
SMILES
CC(=O)OC1=C(C=C2C(=C1)C3=C(O2)C(=C(C(=C3OC(=O)C)OC(=O)C)C4=CC=C(C=C4)O)OC(=O)C)O
InChI
InChI=1S/C26H20O11/c1-11(27)33-20-9-17-19(10-18(20)32)37-26-22(17)25(36-14(4)30)23(34-12(2)28)21(24(26)35-13(3)29)15-5-7-16(31)8-6-15/h5-10,31-32H,1-4H3
InChIKey
OKTVZZFJYXWBMZ-UHFFFAOYSA-N
Compound name
[6,8,9-triacetyloxy-3-hydroxy-7-(4-hydroxyphenyl)dibenzofuran-2-yl] acetate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

508.10056 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 509.10784 212.4
[M+Na]+ 531.08978 220.1
[M-H]- 507.09328 220.6
[M+NH4]+ 526.13438 219.6
[M+K]+ 547.06372 221.8
[M+H-H2O]+ 491.09782 204.6
[M+HCOO]- 553.09876 228.1
[M+CH3COO]- 567.11441 241.7
[M+Na-2H]- 529.07523 210.3
[M]+ 508.10001 225.3
[M]- 508.10111 225.3
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.