CID 12472902

2,3',4,4'-tetrahydroxybenzophenone

Structural Information

Molecular Formula
C13H10O5
SMILES
C1=CC(=C(C=C1C(=O)C2=C(C=C(C=C2)O)O)O)O
InChI
InChI=1S/C13H10O5/c14-8-2-3-9(11(16)6-8)13(18)7-1-4-10(15)12(17)5-7/h1-6,14-17H
InChIKey
UQQYIAVMUUJWGX-UHFFFAOYSA-N
Compound name
(2,4-dihydroxyphenyl)-(3,4-dihydroxyphenyl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

255
Patents

246.05283 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.06011 152.5
[M+Na]+ 269.04205 165.2
[M+NH4]+ 264.08665 158.6
[M+K]+ 285.01599 161.1
[M-H]- 245.04555 153.8
[M+Na-2H]- 267.02750 158.4
[M]+ 246.05228 154.5
[M]- 246.05338 154.5
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