CID 60740592

N-(2-hydroxyethyl)-n-methyloctanamide

Structural Information

Molecular Formula

C₁₁H₂₃NO₂

SMILES

CCCCCCCC(=O)N(C)CCO

InChI

InChI=1S/C11H23NO2/c1-3-4-5-6-7-8-11(14)12(2)9-10-13/h13H,3-10H2,1-2H3

InChIKey

GYMBMKPFELGDCD-UHFFFAOYSA-N

Compound name

N-(2-hydroxyethyl)-N-methyloctanamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 18
Patents: 201.17288 Da
Monoisotopic Mass: 2.0
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]+	202.18016	151.9
[M+Na]+	224.16210	156.1
[M-H]-	200.16560	151.4
[M+NH4]+	219.20670	170.9
[M+K]+	240.13604	155.8
[M+H-H2O]+	184.17014	146.0
[M+HCOO]-	246.17108	173.8
[M+CH3COO]-	260.18673	191.1
[M+Na-2H]-	222.14755	153.9
[M]+	201.17233	155.1
[M]-	201.17343	155.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe