CID 44257567

Pongone

Structural Information

Molecular Formula
C18H12O4
SMILES
COC1=CC=CC(=C1)C2=CC(=O)C3=C(O2)C=C4C(=C3)C=CO4
InChI
InChI=1S/C18H12O4/c1-20-13-4-2-3-11(7-13)17-9-15(19)14-8-12-5-6-21-16(12)10-18(14)22-17/h2-10H,1H3
InChIKey
URNICEODGHJCAQ-UHFFFAOYSA-N
Compound name
7-(3-methoxyphenyl)furo[3,2-g]chromen-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

19
Patents

292.07355 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.08083 162.5
[M+Na]+ 315.06277 175.0
[M-H]- 291.06627 174.0
[M+NH4]+ 310.10737 179.5
[M+K]+ 331.03671 172.9
[M+H-H2O]+ 275.07081 155.5
[M+HCOO]- 337.07175 186.2
[M+CH3COO]- 351.08740 177.1
[M+Na-2H]- 313.04822 170.8
[M]+ 292.07300 170.4
[M]- 292.07410 170.4
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.