CID 122360

N-methyltetradecylamine

Structural Information

Molecular Formula

C₁₅H₃₃N

SMILES

CCCCCCCCCCCCCCNC

InChI

InChI=1S/C15H33N/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-2/h16H,3-15H2,1-2H3

InChIKey

QWERMLCFPMTLTG-UHFFFAOYSA-N

Compound name

N-methyltetradecan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1162
Patents: 227.2613 Da
Monoisotopic Mass: 6.5
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]+	228.26858	163.7
[M+Na]+	250.25052	166.3
[M-H]-	226.25402	162.2
[M+NH4]+	245.29512	181.8
[M+K]+	266.22446	163.7
[M+H-H2O]+	210.25856	157.2
[M+HCOO]-	272.25950	185.5
[M+CH3COO]-	286.27515	199.4
[M+Na-2H]-	248.23597	166.2
[M]+	227.26075	167.6
[M]-	227.26185	167.6

Literature stripe

literature stripe

Patent stripe

patents stripe