CID 131751746

6',7-dihydroxy-2',4'-dimethoxy-3'-prenylflavanone

Structural Information

Molecular Formula
C22H24O6
SMILES
CC(=CCC1=C(C=C(C(=C1OC)C2CC(=O)C3=C(O2)C=C(C=C3)O)O)OC)C
InChI
InChI=1S/C22H24O6/c1-12(2)5-7-15-18(26-3)11-17(25)21(22(15)27-4)20-10-16(24)14-8-6-13(23)9-19(14)28-20/h5-6,8-9,11,20,23,25H,7,10H2,1-4H3
InChIKey
CENDIAJZASJQBF-UHFFFAOYSA-N
Compound name
7-hydroxy-2-[6-hydroxy-2,4-dimethoxy-3-(3-methylbut-2-enyl)phenyl]-2,3-dihydrochromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

384.1573 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 385.16458 191.0
[M+Na]+ 407.14652 198.5
[M-H]- 383.15002 197.0
[M+NH4]+ 402.19112 201.6
[M+K]+ 423.12046 195.8
[M+H-H2O]+ 367.15456 182.9
[M+HCOO]- 429.15550 205.8
[M+CH3COO]- 443.17115 220.2
[M+Na-2H]- 405.13197 190.2
[M]+ 384.15675 195.1
[M]- 384.15785 195.1
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.