CID 8916

Decylamine

Structural Information

Molecular Formula

C₁₀H₂₃N

SMILES

CCCCCCCCCCN

InChI

InChI=1S/C10H23N/c1-2-3-4-5-6-7-8-9-10-11/h2-11H2,1H3

InChIKey

MHZGKXUYDGKKIU-UHFFFAOYSA-N

Compound name

decan-1-amine

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 61
References: 77607
Patents: 157.18304 Da
Monoisotopic Mass: 4.2
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]+	158.190316	141.5
[M+Na]+	180.172258	146.2
[M-H]-	156.175764	140.5
[M+NH4]+	175.216863	162.2
[M+K]+	196.146198	144.6
[M+H-H2O]+	140.180300	136.1
[M+HCOO]-	202.181241	164.4
[M+CH3COO]-	216.196891	183.5
[M+Na-2H]-	178.157706	145.6
[M]+	157.18249142	142.5
[M]-	157.18358858	142.5

Literature stripe

literature stripe

Patent stripe

patents stripe