CID 16075486

9-(4-phenylphenyl)-4-[(e)-styryl]furo[2,3-h]chromen-2-one

Structural Information

Molecular Formula
C31H20O3
SMILES
C1=CC=C(C=C1)/C=C/C2=CC(=O)OC3=C2C=CC4=C3C(=CO4)C5=CC=C(C=C5)C6=CC=CC=C6
InChI
InChI=1S/C31H20O3/c32-29-19-25(12-11-21-7-3-1-4-8-21)26-17-18-28-30(31(26)34-29)27(20-33-28)24-15-13-23(14-16-24)22-9-5-2-6-10-22/h1-20H/b12-11+
InChIKey
QPQMKQGLSJPTTA-VAWYXSNFSA-N
Compound name
4-[(E)-2-phenylethenyl]-9-(4-phenylphenyl)furo[2,3-h]chromen-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

440.14124 Da
Monoisotopic Mass

7.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 441.14852 210.6
[M+Na]+ 463.13046 220.8
[M-H]- 439.13396 226.7
[M+NH4]+ 458.17506 219.9
[M+K]+ 479.10440 214.5
[M+H-H2O]+ 423.13850 199.5
[M+HCOO]- 485.13944 231.2
[M+CH3COO]- 499.15509 220.9
[M+Na-2H]- 461.11591 213.8
[M]+ 440.14069 214.5
[M]- 440.14179 214.5
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.