CID 76121

N-methyl-n-vinylformamide

Structural Information

Molecular Formula

SMILES

CN(C=C)C=O

InChI

InChI=1S/C4H7NO/c1-3-5(2)4-6/h3-4H,1H2,2H3

InChIKey

OFESGEKAXKKFQT-UHFFFAOYSA-N

Compound name

N-ethenyl-N-methylformamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 7762
Patents: 85.052765 Da
Monoisotopic Mass: 0.2
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]+	86.060041	113.1
[M+Na]+	108.041983	121.1
[M-H]-	84.045489	115.3
[M+NH4]+	103.086588	137.4
[M+K]+	124.015923	122.1
[M+H-H2O]+	68.050025	108.7
[M+HCOO]-	130.050966	139.8
[M+CH3COO]-	144.066616	169.5
[M+Na-2H]-	106.027431	120.9
[M]+	85.05221642	114.2
[M]-	85.05331358	114.2

Literature stripe

literature stripe

Patent stripe

patents stripe