CID 31292

Octadecanamide

Structural Information

Molecular Formula

C₁₈H₃₇NO

SMILES

CCCCCCCCCCCCCCCCCC(=O)N

InChI

InChI=1S/C18H37NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2-17H2,1H3,(H2,19,20)

InChIKey

LYRFLYHAGKPMFH-UHFFFAOYSA-N

Compound name

octadecanamide

Related CIDs

2D Structure

compound 2d structure

6
Annotation Hits: 23
References: 100881
Patents: 283.2875 Da
Monoisotopic Mass: 6.8
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]+	284.29478	180.0
[M+Na]+	306.27672	181.4
[M-H]-	282.28022	177.5
[M+NH4]+	301.32132	195.4
[M+K]+	322.25066	177.9
[M+H-H2O]+	266.28476	172.9
[M+HCOO]-	328.28570	199.6
[M+CH3COO]-	342.30135	209.4
[M+Na-2H]-	304.26217	178.5
[M]+	283.28695	184.1
[M]-	283.28805	184.1

Literature stripe

literature stripe

Patent stripe

patents stripe