CID 266805

13289-90-2

Structural Information

Molecular Formula
C11H10O4
SMILES
C1CC(=O)C2=C(C=CC(=C2C(=O)C1)O)O
InChI
InChI=1S/C11H10O4/c12-6-2-1-3-7(13)11-9(15)5-4-8(14)10(6)11/h4-5,14-15H,1-3H2
InChIKey
OBEWSBMNHGZOOT-UHFFFAOYSA-N
Compound name
1,4-dihydroxy-7,8-dihydro-6H-benzo[7]annulene-5,9-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

206.0579 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.06518 138.4
[M+Na]+ 229.04712 148.6
[M+NH4]+ 224.09172 145.2
[M+K]+ 245.02106 145.3
[M-H]- 205.05062 139.0
[M+Na-2H]- 227.03257 142.4
[M]+ 206.05735 139.8
[M]- 206.05845 139.8
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.