CID 74977387

Dtxsid701108713

Structural Information

Molecular Formula
C20H20O5
SMILES
CC(=C)C(CC1=C(C=CC2=C1OC3C2COC4=C3C=CC(=C4)O)O)O
InChI
InChI=1S/C20H20O5/c1-10(2)17(23)8-14-16(22)6-5-12-15-9-24-18-7-11(21)3-4-13(18)20(15)25-19(12)14/h3-7,15,17,20-23H,1,8-9H2,2H3
InChIKey
LRCYZCCKRIVTHN-UHFFFAOYSA-N
Compound name
10-(2-hydroxy-3-methylbut-3-enyl)-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromene-3,9-diol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

0
Patents

340.13107 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 341.13835 178.6
[M+Na]+ 363.12029 185.6
[M-H]- 339.12379 182.3
[M+NH4]+ 358.16489 192.4
[M+K]+ 379.09423 182.7
[M+H-H2O]+ 323.12833 173.2
[M+HCOO]- 385.12927 189.0
[M+CH3COO]- 399.14492 188.1
[M+Na-2H]- 361.10574 180.0
[M]+ 340.13052 179.6
[M]- 340.13162 179.6
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.