CID 42607738

Furano[2'',3'':6,7]aurone

Structural Information

Molecular Formula
C17H10O3
SMILES
C1=CC=C(C=C1)C=C2C(=O)C3=C(O2)C4=C(C=C3)OC=C4
InChI
InChI=1S/C17H10O3/c18-16-13-6-7-14-12(8-9-19-14)17(13)20-15(16)10-11-4-2-1-3-5-11/h1-10H
InChIKey
YVBYFIDGVMQYJN-UHFFFAOYSA-N
Compound name
2-benzylidenefuro[2,3-e][1]benzofuran-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

262.063 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.07028 155.2
[M+Na]+ 285.05222 166.8
[M-H]- 261.05572 166.4
[M+NH4]+ 280.09682 175.1
[M+K]+ 301.02616 163.8
[M+H-H2O]+ 245.06026 150.3
[M+HCOO]- 307.06120 178.9
[M+CH3COO]- 321.07685 170.0
[M+Na-2H]- 283.03767 161.1
[M]+ 262.06245 159.8
[M]- 262.06355 159.8
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

No patent data available for this compound.