CID 19766

3886-91-7

Structural Information

Molecular Formula

C₁₈H₃₇NO

SMILES

CCCCCCCCCCCCCCCC(=O)N(C)C

InChI

InChI=1S/C18H37NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(20)19(2)3/h4-17H2,1-3H3

InChIKey

UOYBMZNFJUBBNU-UHFFFAOYSA-N

Compound name

N,N-dimethylhexadecanamide

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 1
References: 394
Patents: 283.2875 Da
Monoisotopic Mass: 6.3
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	180.6
[M+Na]+	306.27672	182.3
[M-H]-	282.28022	180.2
[M+NH4]+	301.32132	197.1
[M+K]+	322.25066	180.6
[M+H-H2O]+	266.28476	173.4
[M+HCOO]-	328.28570	201.4
[M+CH3COO]-	342.30135	212.9
[M+Na-2H]-	304.26217	179.4
[M]+	283.28695	187.0
[M]-	283.28805	187.0

Literature stripe

literature stripe

Patent stripe

patents stripe