CID 44257465

2,8-dihydroxy-3,4,9,10-tetramethoxypterocarpan

Structural Information

Molecular Formula
C19H20O8
SMILES
COC1=C(C=C2C3COC4=C(C(=C(C=C4C3OC2=C1OC)O)OC)OC)O
InChI
InChI=1S/C19H20O8/c1-22-16-12(21)6-9-13-10(7-26-14(9)18(16)24-3)8-5-11(20)17(23-2)19(25-4)15(8)27-13/h5-6,10,13,20-21H,7H2,1-4H3
InChIKey
OADZLSQNPZPBEF-UHFFFAOYSA-N
Compound name
3,4,9,10-tetramethoxy-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromene-2,8-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

376.1158 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 377.12308 182.7
[M+Na]+ 399.10502 192.5
[M-H]- 375.10852 188.8
[M+NH4]+ 394.14962 196.4
[M+K]+ 415.07896 192.8
[M+H-H2O]+ 359.11306 176.8
[M+HCOO]- 421.11400 197.0
[M+CH3COO]- 435.12965 218.4
[M+Na-2H]- 397.09047 186.1
[M]+ 376.11525 192.6
[M]- 376.11635 192.6
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.