CID 5376215

14348-23-3

Structural Information

Molecular Formula
C11H6O5
SMILES
C1=CC(=O)OC2=C(C3=C(C=CO3)C(=C21)O)O
InChI
InChI=1S/C11H6O5/c12-7-2-1-5-8(13)6-3-4-15-10(6)9(14)11(5)16-7/h1-4,13-14H
InChIKey
DZEPISXWRUMGFN-UHFFFAOYSA-N
Compound name
4,9-dihydroxyfuro[3,2-g]chromen-7-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

29
Patents

218.02153 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.02881 137.6
[M+Na]+ 241.01075 150.9
[M-H]- 217.01425 143.9
[M+NH4]+ 236.05535 156.8
[M+K]+ 256.98469 149.5
[M+H-H2O]+ 201.01879 133.2
[M+HCOO]- 263.01973 159.7
[M+CH3COO]- 277.03538 153.0
[M+Na-2H]- 238.99620 147.5
[M]+ 218.02098 143.9
[M]- 218.02208 143.9
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.