CID 22670774

(2e,4e)-5-(4-hydroxyphenyl)penta-2,4-dienal

Structural Information

Molecular Formula

C₁₁H₁₀O₂

SMILES

C1=CC(=CC=C1/C=C/C=C/C=O)O

InChI

InChI=1S/C11H10O2/c12-9-3-1-2-4-10-5-7-11(13)8-6-10/h1-9,13H/b3-1+,4-2+

InChIKey

VXAQSYLNHLSHDY-ZPUQHVIOSA-N

Compound name

(2E,4E)-5-(4-hydroxyphenyl)penta-2,4-dienal

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 11
Patents: 174.06808 Da
Monoisotopic Mass: 2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	175.07536	137.9
[M+Na]+	197.05730	150.6
[M+NH4]+	192.10190	145.6
[M+K]+	213.03124	143.2
[M-H]-	173.06080	139.1
[M+Na-2H]-	195.04275	144.1
[M]+	174.06753	139.8
[M]-	174.06863	139.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe