CID 707822

7-methyl-10-(4-methylphenyl)-5h-benzo[c]furo[3,2-g]chromen-5-one

Structural Information

Molecular Formula
C23H16O3
SMILES
CC1=CC=C(C=C1)C2=COC3=C2C=C4C5=CC=CC=C5C(=O)OC4=C3C
InChI
InChI=1S/C23H16O3/c1-13-7-9-15(10-8-13)20-12-25-21-14(2)22-18(11-19(20)21)16-5-3-4-6-17(16)23(24)26-22/h3-12H,1-2H3
InChIKey
OPPPBVAOQGAARB-UHFFFAOYSA-N
Compound name
7-methyl-10-(4-methylphenyl)-[1]benzofuro[6,5-c]isochromen-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

340.10995 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 341.11723 180.0
[M+Na]+ 363.09917 194.3
[M-H]- 339.10267 192.9
[M+NH4]+ 358.14377 196.3
[M+K]+ 379.07311 190.1
[M+H-H2O]+ 323.10721 172.0
[M+HCOO]- 385.10815 202.4
[M+CH3COO]- 399.12380 193.9
[M+Na-2H]- 361.08462 187.1
[M]+ 340.10940 188.7
[M]- 340.11050 188.7
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.