CID 11725803

Flavanone base + 4o, 1prenyl

Structural Information

Molecular Formula
C20H20O6
SMILES
CC(=CCC1=C(C(=CC(=C1)C2CC(=O)C3=C(C=C(C=C3O2)O)O)O)O)C
InChI
InChI=1S/C20H20O6/c1-10(2)3-4-11-5-12(6-16(24)20(11)25)17-9-15(23)19-14(22)7-13(21)8-18(19)26-17/h3,5-8,17,21-22,24-25H,4,9H2,1-2H3
InChIKey
SFQIGPZCFNTPOD-UHFFFAOYSA-N
Compound name
2-[3,4-dihydroxy-5-(3-methylbut-2-enyl)phenyl]-5,7-dihydroxy-2,3-dihydrochromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

356.12598 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 357.13326 183.0
[M+Na]+ 379.11520 190.5
[M-H]- 355.11870 186.6
[M+NH4]+ 374.15980 193.3
[M+K]+ 395.08914 186.6
[M+H-H2O]+ 339.12324 175.8
[M+HCOO]- 401.12418 195.4
[M+CH3COO]- 415.13983 210.2
[M+Na-2H]- 377.10065 182.3
[M]+ 356.12543 182.9
[M]- 356.12653 182.9
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