CID 14471

N-methylacrylamide

Structural Information

Molecular Formula
C4H7NO
SMILES
CNC(=O)C=C
InChI
InChI=1S/C4H7NO/c1-3-4(6)5-2/h3H,1H2,2H3,(H,5,6)
InChIKey
YPHQUSNPXDGUHL-UHFFFAOYSA-N
Compound name
N-methylprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

8
References

38320
Patents

85.052765 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 86.060041 115.5
[M+Na]+ 108.04198 125.5
[M+NH4]+ 103.08659 123.5
[M+K]+ 124.01592 120.5
[M-H]- 84.045489 115.3
[M+Na-2H]- 106.02743 119.8
[M]+ 85.052216 116.5
[M]- 85.053314 116.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe