CID 368011

Nsc638240

Structural Information

Molecular Formula
C15H10O5
SMILES
C1=CC=C2C(=C1)C(=O)C3(C2(OC4=CC=CC(=C43)O)O)O
InChI
InChI=1S/C15H10O5/c16-10-6-3-7-11-12(10)14(18)13(17)8-4-1-2-5-9(8)15(14,19)20-11/h1-7,16,18-19H
InChIKey
KKHBRWHPOSULMF-UHFFFAOYSA-N
Compound name
4b,9,9b-trihydroxyindeno[1,2-b][1]benzofuran-10-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

270.05283 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.06011 155.6
[M+Na]+ 293.04205 167.9
[M-H]- 269.04555 160.5
[M+NH4]+ 288.08665 179.7
[M+K]+ 309.01599 163.5
[M+H-H2O]+ 253.05009 152.4
[M+HCOO]- 315.05103 173.2
[M+CH3COO]- 329.06668 169.0
[M+Na-2H]- 291.02750 162.9
[M]+ 270.05228 158.5
[M]- 270.05338 158.5
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.