CID 5464639

3-hydroxy-4-methoxyxanthone

Structural Information

Molecular Formula
C14H10O4
SMILES
COC1=C(C=CC2=C1OC3=CC=CC=C3C2=O)O
InChI
InChI=1S/C14H10O4/c1-17-14-10(15)7-6-9-12(16)8-4-2-3-5-11(8)18-13(9)14/h2-7,15H,1H3
InChIKey
WRPFBSLWEKZESU-UHFFFAOYSA-N
Compound name
3-hydroxy-4-methoxyxanthen-9-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

0
Patents

242.0579 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.06518 147.0
[M+Na]+ 265.04712 159.5
[M-H]- 241.05062 153.5
[M+NH4]+ 260.09172 165.4
[M+K]+ 281.02106 156.8
[M+H-H2O]+ 225.05516 140.5
[M+HCOO]- 287.05610 169.5
[M+CH3COO]- 301.07175 161.5
[M+Na-2H]- 263.03257 157.5
[M]+ 242.05735 153.1
[M]- 242.05845 153.1
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.