CID 178

Acetamide

Structural Information

Molecular Formula

SMILES

CC(=O)N

InChI

InChI=1S/C2H5NO/c1-2(3)4/h1H3,(H2,3,4)

InChIKey

DLFVBJFMPXGRIB-UHFFFAOYSA-N

Compound name

acetamide

Related CIDs

2D Structure

compound 2d structure

10
Annotation Hits: 1230
References: 116833
Patents: 59.037113 Da
Monoisotopic Mass: -0.9
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]+	60.044389	106.9
[M+Na]+	82.026331	115.0
[M-H]-	58.029837	107.4
[M+NH4]+	77.070936	131.3
[M+K]+	98.000271	115.8
[M+H-H2O]+	42.034373	103.0
[M+HCOO]-	104.03531	131.8
[M+CH3COO]-	118.05096	160.9
[M+Na-2H]-	80.011779	114.0
[M]+	59.036564	104.9
[M]-	59.037662	104.9

Literature stripe

literature stripe

Patent stripe

patents stripe