CID 15160715

Ovalifolin

Structural Information

Molecular Formula
C22H18O4
SMILES
CC(=CCOC1=C2C(=C3C(=C1)C(=O)C=C(O3)C4=CC=CC=C4)C=CO2)C
InChI
InChI=1S/C22H18O4/c1-14(2)8-10-24-20-12-17-18(23)13-19(15-6-4-3-5-7-15)26-21(17)16-9-11-25-22(16)20/h3-9,11-13H,10H2,1-2H3
InChIKey
VZSKLDHXYLNZMO-UHFFFAOYSA-N
Compound name
6-(3-methylbut-2-enoxy)-2-phenylfuro[2,3-h]chromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

19
Patents

346.1205 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 347.12778 181.7
[M+Na]+ 369.10972 192.3
[M-H]- 345.11322 192.5
[M+NH4]+ 364.15432 196.3
[M+K]+ 385.08366 189.3
[M+H-H2O]+ 329.11776 174.1
[M+HCOO]- 391.11870 203.1
[M+CH3COO]- 405.13435 194.3
[M+Na-2H]- 367.09517 186.5
[M]+ 346.11995 189.4
[M]- 346.12105 189.4
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

patents stripe