CID 131751080

11-methoxynoryangonin

Structural Information

Molecular Formula
C15H14O5
SMILES
COC1=CC(=O)OC(=C1)/C=C\C2=CC(=C(C=C2)O)OC
InChI
InChI=1S/C15H14O5/c1-18-12-8-11(20-15(17)9-12)5-3-10-4-6-13(16)14(7-10)19-2/h3-9,16H,1-2H3/b5-3-
InChIKey
YHVDGZPFCGLBOW-HYXAFXHYSA-N
Compound name
6-[(Z)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]-4-methoxypyran-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

274.08414 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.09142 158.3
[M+Na]+ 297.07336 168.1
[M-H]- 273.07686 165.4
[M+NH4]+ 292.11796 173.0
[M+K]+ 313.04730 166.1
[M+H-H2O]+ 257.08140 150.9
[M+HCOO]- 319.08234 181.4
[M+CH3COO]- 333.09799 195.6
[M+Na-2H]- 295.05881 163.5
[M]+ 274.08359 163.8
[M]- 274.08469 163.8
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

patents stripe