CID 25245279

(z)-3-hydroxy-1-(4-hydroxy-2-methoxyphenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one

Structural Information

Molecular Formula
C16H14O5
SMILES
COC1=C(C=CC(=C1)O)C(=O)/C=C(/C2=CC=C(C=C2)O)\O
InChI
InChI=1S/C16H14O5/c1-21-16-8-12(18)6-7-13(16)15(20)9-14(19)10-2-4-11(17)5-3-10/h2-9,17-19H,1H3/b14-9-
InChIKey
SVYAXLPDYXBQEQ-ZROIWOOFSA-N
Compound name
(Z)-3-hydroxy-1-(4-hydroxy-2-methoxyphenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

286.08414 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.091416 163.1
[M+Na]+ 309.073358 169.8
[M-H]- 285.076864 166.2
[M+NH4]+ 304.117963 176.5
[M+K]+ 325.047298 166.0
[M+H-H2O]+ 269.081400 156.1
[M+HCOO]- 331.082341 181.6
[M+CH3COO]- 345.097991 194.3
[M+Na-2H]- 307.058806 164.2
[M]+ 286.08359142 162.9
[M]- 286.08468858 162.9
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.