CID 3034270

1-(4-hydroxy-3,5-dimethoxyphenyl)-1-propanone 2-[1-(4-hydroxy-3,5-dimethoxyphenyl)propylidene]hydrazone

Structural Information

Molecular Formula
C22H28N2O6
SMILES
CCC(=NN=C(CC)C1=CC(=C(C(=C1)OC)O)OC)C2=CC(=C(C(=C2)OC)O)OC
InChI
InChI=1S/C22H28N2O6/c1-7-15(13-9-17(27-3)21(25)18(10-13)28-4)23-24-16(8-2)14-11-19(29-5)22(26)20(12-14)30-6/h9-12,25-26H,7-8H2,1-6H3
InChIKey
DVVQQGUHFRQXLF-UHFFFAOYSA-N
Compound name
4-[C-ethyl-N-[1-(4-hydroxy-3,5-dimethoxyphenyl)propylideneamino]carbonimidoyl]-2,6-dimethoxyphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

416.19473 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 417.20201 201.2
[M+Na]+ 439.18395 211.6
[M+NH4]+ 434.22855 205.1
[M+K]+ 455.15789 206.6
[M-H]- 415.18745 203.9
[M+Na-2H]- 437.16940 205.1
[M]+ 416.19418 203.1
[M]- 416.19528 203.1
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

patents stripe