CID 21680431

3'-hydroxy-2',4',5',6'-tetramethoxychalcone

Structural Information

Molecular Formula
C19H20O6
SMILES
COC1=C(C(=C(C(=C1O)OC)OC)OC)C(=O)/C=C/C2=CC=CC=C2
InChI
InChI=1S/C19H20O6/c1-22-16-14(13(20)11-10-12-8-6-5-7-9-12)17(23-2)19(25-4)18(24-3)15(16)21/h5-11,21H,1-4H3/b11-10+
InChIKey
RZSYQUHEIMQENQ-ZHACJKMWSA-N
Compound name
(E)-1-(3-hydroxy-2,4,5,6-tetramethoxyphenyl)-3-phenylprop-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

344.12598 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 345.13326 177.7
[M+Na]+ 367.11520 185.8
[M-H]- 343.11870 183.7
[M+NH4]+ 362.15980 190.7
[M+K]+ 383.08914 183.4
[M+H-H2O]+ 327.12324 169.5
[M+HCOO]- 389.12418 199.3
[M+CH3COO]- 403.13983 211.7
[M+Na-2H]- 365.10065 178.2
[M]+ 344.12543 185.1
[M]- 344.12653 185.1
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.