CID 10517292

3-hydroxy-2-(3,4,5-trihydroxyphenyl)-4h-chromen-4-one

Structural Information

Molecular Formula
C15H10O6
SMILES
C1=CC=C2C(=C1)C(=O)C(=C(O2)C3=CC(=C(C(=C3)O)O)O)O
InChI
InChI=1S/C15H10O6/c16-9-5-7(6-10(17)13(9)19)15-14(20)12(18)8-3-1-2-4-11(8)21-15/h1-6,16-17,19-20H
InChIKey
FBWPKKNAKFWYOJ-UHFFFAOYSA-N
Compound name
3-hydroxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

26
Patents

286.04773 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.05501 159.5
[M+Na]+ 309.03695 170.4
[M-H]- 285.04045 164.4
[M+NH4]+ 304.08155 172.7
[M+K]+ 325.01089 167.0
[M+H-H2O]+ 269.04499 152.6
[M+HCOO]- 331.04593 177.4
[M+CH3COO]- 345.06158 193.5
[M+Na-2H]- 307.02240 165.1
[M]+ 286.04718 161.5
[M]- 286.04828 161.5
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

patents stripe