CID 4181541

7516-82-7

Structural Information

Molecular Formula

C₁₁H₂₅N

SMILES

CCCCCCCCCCNC

InChI

InChI=1S/C11H25N/c1-3-4-5-6-7-8-9-10-11-12-2/h12H,3-11H2,1-2H3

InChIKey

IKVDMBQGHZVMRN-UHFFFAOYSA-N

Compound name

N-methyldecan-1-amine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 1797
Patents: 171.1987 Da
Monoisotopic Mass: 4.8
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]+	172.20598	145.7
[M+Na]+	194.18792	149.9
[M-H]-	170.19142	145.0
[M+NH4]+	189.23252	166.1
[M+K]+	210.16186	148.4
[M+H-H2O]+	154.19596	140.0
[M+HCOO]-	216.19690	168.8
[M+CH3COO]-	230.21255	187.3
[M+Na-2H]-	192.17337	150.3
[M]+	171.19815	148.1
[M]-	171.19925	148.1

Literature stripe

literature stripe

Patent stripe

patents stripe