CID 18346914

30272-74-3

Structural Information

Molecular Formula
C10H6O4
SMILES
C1C2=CC3=C(CC(=O)O3)C=C2OC1=O
InChI
InChI=1S/C10H6O4/c11-9-3-5-1-7-6(2-8(5)14-9)4-10(12)13-7/h1-2H,3-4H2
InChIKey
CQYVZXUUXPGQEI-UHFFFAOYSA-N
Compound name
3,7-dihydrofuro[2,3-f][1]benzofuran-2,6-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

91
Patents

190.02661 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.03389 133.0
[M+Na]+ 213.01583 144.0
[M-H]- 189.01933 140.7
[M+NH4]+ 208.06043 156.0
[M+K]+ 228.98977 143.7
[M+H-H2O]+ 173.02387 130.0
[M+HCOO]- 235.02481 155.0
[M+CH3COO]- 249.04046 148.6
[M+Na-2H]- 211.00128 139.6
[M]+ 190.02606 136.4
[M]- 190.02716 136.4
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