CID 134816744

Garciosone a

Structural Information

Molecular Formula
C15H14O6
SMILES
COC1=CC(=CC(=C1C(=O)C2=CC(=CC(=C2)O)O)OC)O
InChI
InChI=1S/C15H14O6/c1-20-12-6-11(18)7-13(21-2)14(12)15(19)8-3-9(16)5-10(17)4-8/h3-7,16-18H,1-2H3
InChIKey
NHRIHWRYMDXWBM-UHFFFAOYSA-N
Compound name
(3,5-dihydroxyphenyl)-(4-hydroxy-2,6-dimethoxyphenyl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

290.07904 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.08632 161.5
[M+Na]+ 313.06826 170.2
[M-H]- 289.07176 165.5
[M+NH4]+ 308.11286 175.3
[M+K]+ 329.04220 167.6
[M+H-H2O]+ 273.07630 154.6
[M+HCOO]- 335.07724 181.3
[M+CH3COO]- 349.09289 196.7
[M+Na-2H]- 311.05371 163.1
[M]+ 290.07849 164.7
[M]- 290.07959 164.7
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.