CID 1780950

374768-07-7

Structural Information

Molecular Formula
C30H20O3
SMILES
CC1=C2C(=CC3=C1OC=C3C4=CC=C(C=C4)C5=CC=CC=C5)C(=CC(=O)O2)C6=CC=CC=C6
InChI
InChI=1S/C30H20O3/c1-19-29-26(16-25-24(17-28(31)33-30(19)25)22-10-6-3-7-11-22)27(18-32-29)23-14-12-21(13-15-23)20-8-4-2-5-9-20/h2-18H,1H3
InChIKey
MFZBIZIKRDFKKD-UHFFFAOYSA-N
Compound name
9-methyl-5-phenyl-3-(4-phenylphenyl)furo[3,2-g]chromen-7-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

428.14124 Da
Monoisotopic Mass

7.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 429.14852 207.4
[M+Na]+ 451.13046 218.5
[M-H]- 427.13396 224.1
[M+NH4]+ 446.17506 217.5
[M+K]+ 467.10440 213.2
[M+H-H2O]+ 411.13850 196.5
[M+HCOO]- 473.13944 228.2
[M+CH3COO]- 487.15509 218.4
[M+Na-2H]- 449.11591 210.5
[M]+ 428.14069 212.3
[M]- 428.14179 212.3
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.