CID 6438866

76554-66-0

Structural Information

Molecular Formula
C19H20O5
SMILES
CCOC1=CC(=C(C(=C1)OC)C(=O)/C=C/C2=CC=C(C=C2)OC)O
InChI
InChI=1S/C19H20O5/c1-4-24-15-11-17(21)19(18(12-15)23-3)16(20)10-7-13-5-8-14(22-2)9-6-13/h5-12,21H,4H2,1-3H3/b10-7+
InChIKey
IZRDKZYYVCGVRH-JXMROGBWSA-N
Compound name
(E)-1-(4-ethoxy-2-hydroxy-6-methoxyphenyl)-3-(4-methoxyphenyl)prop-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

19
References

23
Patents

328.13107 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 329.13835 175.6
[M+Na]+ 351.12029 183.1
[M-H]- 327.12379 181.2
[M+NH4]+ 346.16489 189.1
[M+K]+ 367.09423 179.8
[M+H-H2O]+ 311.12833 167.5
[M+HCOO]- 373.12927 197.1
[M+CH3COO]- 387.14492 208.2
[M+Na-2H]- 349.10574 176.6
[M]+ 328.13052 181.2
[M]- 328.13162 181.2
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.