CID 1757029

3-(4-methoxyphenyl)-9-methyl-5-phenyl-7h-furo[3,2-g]chromen-7-one

Structural Information

Molecular Formula
C25H18O4
SMILES
CC1=C2C(=CC3=C1OC=C3C4=CC=C(C=C4)OC)C(=CC(=O)O2)C5=CC=CC=C5
InChI
InChI=1S/C25H18O4/c1-15-24-21(22(14-28-24)17-8-10-18(27-2)11-9-17)12-20-19(13-23(26)29-25(15)20)16-6-4-3-5-7-16/h3-14H,1-2H3
InChIKey
JMPUVZYOGOKRSI-UHFFFAOYSA-N
Compound name
3-(4-methoxyphenyl)-9-methyl-5-phenylfuro[3,2-g]chromen-7-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

382.1205 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 383.12778 192.0
[M+Na]+ 405.10972 204.2
[M-H]- 381.11322 206.5
[M+NH4]+ 400.15432 205.0
[M+K]+ 421.08366 200.6
[M+H-H2O]+ 365.11776 182.9
[M+HCOO]- 427.11870 214.1
[M+CH3COO]- 441.13435 204.7
[M+Na-2H]- 403.09517 196.6
[M]+ 382.11995 199.9
[M]- 382.12105 199.9
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.