CID 3086631

Tradecamide

Structural Information

Molecular Formula

C₁₅H₃₁NO₂

SMILES

CN(C)C(=O)CCCCCCCCCCCCO

InChI

InChI=1S/C15H31NO2/c1-16(2)15(18)13-11-9-7-5-3-4-6-8-10-12-14-17/h17H,3-14H2,1-2H3

InChIKey

YWPSCECSGOKQRM-UHFFFAOYSA-N

Compound name

13-hydroxy-N,N-dimethyltridecanamide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 71
Patents: 257.23547 Da
Monoisotopic Mass: 3.8
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]+	258.242746	170.3
[M+Na]+	280.224688	172.7
[M-H]-	256.228194	169.0
[M+NH4]+	275.269293	187.0
[M+K]+	296.198628	171.4
[M+H-H2O]+	240.232730	163.6
[M+HCOO]-	302.233671	190.8
[M+CH3COO]-	316.249321	203.2
[M+Na-2H]-	278.210136	170.1
[M]+	257.23492142	174.9
[M]-	257.23601858	174.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe