CID 12536856

(z)-4-decenedial

Structural Information

Molecular Formula

C₁₀H₁₆O₂

SMILES

C(CCC=O)C/C=C\CCC=O

InChI

InChI=1S/C10H16O2/c11-9-7-5-3-1-2-4-6-8-10-12/h1,3,9-10H,2,4-8H2/b3-1-

InChIKey

SLTFGUKJPFZNHR-IWQZZHSRSA-N

Compound name

(Z)-dec-4-enedial

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 168.11504 Da
Monoisotopic Mass: 1.2
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]+	169.122316	138.4
[M+Na]+	191.104258	145.0
[M-H]-	167.107764	138.1
[M+NH4]+	186.148863	159.1
[M+K]+	207.078198	142.9
[M+H-H2O]+	151.112300	133.4
[M+HCOO]-	213.113241	162.1
[M+CH3COO]-	227.128891	179.9
[M+Na-2H]-	189.089706	143.6
[M]+	168.11449142	142.1
[M]-	168.11558858	142.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe