CID 11199650

Tricetinidin

Structural Information

Molecular Formula
C15H11O6
SMILES
C1=CC(=[O+]C2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O
InChI
InChI=1S/C15H10O6/c16-8-5-10(17)9-1-2-13(21-14(9)6-8)7-3-11(18)15(20)12(19)4-7/h1-6H,(H4-,16,17,18,19,20)/p+1
InChIKey
CMPNIWQMRYYTMK-UHFFFAOYSA-O
Compound name
5-(5,7-dihydroxychromenylium-2-yl)benzene-1,2,3-triol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

2
References

1177
Patents

287.05557 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.06285 160.0
[M+Na]+ 310.04479 176.7
[M+NH4]+ 305.08939 167.6
[M+K]+ 326.01873 172.9
[M-H]- 286.04829 165.3
[M+Na-2H]- 308.03024 166.3
[M]+ 287.05502 164.2
[M]- 287.05612 164.2
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