CID 11638585

Brffhcompmjeik-uhfffaoysa-

Structural Information

Molecular Formula
C19H12O6
SMILES
COC1=CC2=C(C=C1C3=CC(=O)C4=C(O3)C5=C(C=C4)OC=C5)OCO2
InChI
InChI=1S/C19H12O6/c1-21-15-8-18-17(23-9-24-18)6-12(15)16-7-13(20)10-2-3-14-11(4-5-22-14)19(10)25-16/h2-8H,9H2,1H3
InChIKey
BRFFHCOMPMJEIK-UHFFFAOYSA-N
Compound name
2-(6-methoxy-1,3-benzodioxol-5-yl)furo[2,3-h]chromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

336.0634 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 337.07068 170.5
[M+Na]+ 359.05262 183.5
[M-H]- 335.05612 184.5
[M+NH4]+ 354.09722 185.7
[M+K]+ 375.02656 184.3
[M+H-H2O]+ 319.06066 166.1
[M+HCOO]- 381.06160 191.1
[M+CH3COO]- 395.07725 185.0
[M+Na-2H]- 357.03807 177.2
[M]+ 336.06285 181.4
[M]- 336.06395 181.4
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.