CID 106459

2-decenenitrile

Structural Information

Molecular Formula

C₁₀H₁₇N

SMILES

CCCCCCCC=CC#N

InChI

InChI=1S/C10H17N/c1-2-3-4-5-6-7-8-9-10-11/h8-9H,2-7H2,1H3

InChIKey

ILRJSGCEAPKUQT-UHFFFAOYSA-N

Compound name

dec-2-enenitrile

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 25
Patents: 151.1361 Da
Monoisotopic Mass: 3.9
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]+	152.143376	133.1
[M+Na]+	174.125318	141.2
[M-H]-	150.128824	133.6
[M+NH4]+	169.169923	152.6
[M+K]+	190.099258	139.1
[M+H-H2O]+	134.133360	121.9
[M+HCOO]-	196.134301	152.7
[M+CH3COO]-	210.149951	191.6
[M+Na-2H]-	172.110766	138.5
[M]+	151.13555142	130.3
[M]-	151.13664858	130.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe