CID 135398753

Hohpda

Structural Information

Molecular Formula
C12H10O5
SMILES
C1=CC=C(C(=C1)C(=O)/C=C\C=C(/C(=O)O)\O)O
InChI
InChI=1S/C12H10O5/c13-9-5-2-1-4-8(9)10(14)6-3-7-11(15)12(16)17/h1-7,13,15H,(H,16,17)/b6-3-,11-7+
InChIKey
MWGXDZHCLRMDFE-TZFLZTJBSA-N
Compound name
(2E,4Z)-2-hydroxy-6-(2-hydroxyphenyl)-6-oxohexa-2,4-dienoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

234.05283 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.06011 151.3
[M+Na]+ 257.04205 160.2
[M+NH4]+ 252.08665 155.6
[M+K]+ 273.01599 157.3
[M-H]- 233.04555 148.8
[M+Na-2H]- 255.02750 153.4
[M]+ 234.05228 151.2
[M]- 234.05338 151.2
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.