CID 118726653

Moracin k

Structural Information

Molecular Formula
C19H16O5
SMILES
CC1(C=CC2=C3C(=CC(=C2O1)O)C=C(O3)C4=CC(=CC(=C4)O)O)C
InChI
InChI=1S/C19H16O5/c1-19(2)4-3-14-17-11(7-15(22)18(14)24-19)8-16(23-17)10-5-12(20)9-13(21)6-10/h3-9,20-22H,1-2H3
InChIKey
HRYWITBPMMQCBB-UHFFFAOYSA-N
Compound name
5-(5-hydroxy-7,7-dimethylfuro[2,3-f]chromen-2-yl)benzene-1,3-diol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

0
Patents

324.09976 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.10704 172.8
[M+Na]+ 347.08898 184.9
[M-H]- 323.09248 180.9
[M+NH4]+ 342.13358 189.0
[M+K]+ 363.06292 181.9
[M+H-H2O]+ 307.09702 166.9
[M+HCOO]- 369.09796 190.2
[M+CH3COO]- 383.11361 185.4
[M+Na-2H]- 345.07443 178.7
[M]+ 324.09921 178.0
[M]- 324.10031 178.0
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.