CID 68083

4h-furo(3,2-g)(1)benzopyran-4,7,9-trione

Structural Information

Molecular Formula
C11H4O5
SMILES
C1=CC(=O)OC2=C1C(=O)C3=C(C2=O)OC=C3
InChI
InChI=1S/C11H4O5/c12-7-2-1-5-8(13)6-3-4-15-10(6)9(14)11(5)16-7/h1-4H
InChIKey
HKQPXEAYQPNPHV-UHFFFAOYSA-N
Compound name
furo[3,2-g]chromene-4,7,9-trione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

6
Patents

216.00587 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.01315 135.7
[M+Na]+ 238.99509 148.5
[M-H]- 214.99859 144.1
[M+NH4]+ 234.03969 156.1
[M+K]+ 254.96903 147.9
[M+H-H2O]+ 199.00313 131.2
[M+HCOO]- 261.00407 158.4
[M+CH3COO]- 275.01972 151.6
[M+Na-2H]- 236.98054 144.8
[M]+ 216.00532 141.3
[M]- 216.00642 141.3
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