CID 44257647

Hookerianin

Structural Information

Molecular Formula
C23H20O6
SMILES
CC1(C=C(C(=O)O1)C2=C(C=C(C3=C2OC(=CC3=O)C4=CC=CC=C4)OC)OC)C
InChI
InChI=1S/C23H20O6/c1-23(2)12-14(22(25)29-23)19-17(26-3)11-18(27-4)20-15(24)10-16(28-21(19)20)13-8-6-5-7-9-13/h5-12H,1-4H3
InChIKey
NVGQZFJWDWMWMT-UHFFFAOYSA-N
Compound name
8-(5,5-dimethyl-2-oxofuran-3-yl)-5,7-dimethoxy-2-phenylchromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

392.12598 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 393.13326 190.2
[M+Na]+ 415.11520 201.9
[M-H]- 391.11870 204.0
[M+NH4]+ 410.15980 204.1
[M+K]+ 431.08914 200.6
[M+H-H2O]+ 375.12324 182.2
[M+HCOO]- 437.12418 211.3
[M+CH3COO]- 451.13983 222.6
[M+Na-2H]- 413.10065 193.0
[M]+ 392.12543 199.4
[M]- 392.12653 199.4
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.