CID 4432301

2'-(dodecyloxy)acetanilide

Structural Information

Molecular Formula

C₂₀H₃₃NO₂

SMILES

CCCCCCCCCCCCOC1=CC=CC=C1NC(=O)C

InChI

InChI=1S/C20H33NO2/c1-3-4-5-6-7-8-9-10-11-14-17-23-20-16-13-12-15-19(20)21-18(2)22/h12-13,15-16H,3-11,14,17H2,1-2H3,(H,21,22)

InChIKey

GYWGKBMXOOAFBK-UHFFFAOYSA-N

Compound name

N-(2-dodecoxyphenyl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 319.25113 Da
Monoisotopic Mass: 6.7
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]+	320.258406	184.0
[M+Na]+	342.240348	186.7
[M-H]-	318.243854	185.8
[M+NH4]+	337.284953	198.1
[M+K]+	358.214288	182.9
[M+H-H2O]+	302.248390	175.7
[M+HCOO]-	364.249331	205.5
[M+CH3COO]-	378.264981	213.7
[M+Na-2H]-	340.225796	184.5
[M]+	319.25058142	188.9
[M]-	319.25167858	188.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe