CID 5282782

(2e,4e)-2,4-decadienoic acid

Structural Information

Molecular Formula

C₁₀H₁₆O₂

SMILES

CCCCC/C=C/C=C/C(=O)O

InChI

InChI=1S/C10H16O2/c1-2-3-4-5-6-7-8-9-10(11)12/h6-9H,2-5H2,1H3,(H,11,12)/b7-6+,9-8+

InChIKey

YKHVVNDSWHSBPA-BLHCBFLLSA-N

Compound name

(2E,4E)-deca-2,4-dienoic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1058
Patents: 168.11504 Da
Monoisotopic Mass: 3.3
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]+	169.12232	140.9
[M+Na]+	191.10426	150.0
[M+NH4]+	186.14886	147.2
[M+K]+	207.07820	143.9
[M-H]-	167.10776	138.8
[M+Na-2H]-	189.08971	142.7
[M]+	168.11449	141.2
[M]-	168.11559	141.2

Literature stripe

literature stripe

Patent stripe

patents stripe