CID 75820

N-((dimethylamino)methyl)acrylamide

Structural Information

Molecular Formula
C6H12N2O
SMILES
CN(C)CNC(=O)C=C
InChI
InChI=1S/C6H12N2O/c1-4-6(9)7-5-8(2)3/h4H,1,5H2,2-3H3,(H,7,9)
InChIKey
OOUWNHAYYDNAOD-UHFFFAOYSA-N
Compound name
N-[(dimethylamino)methyl]prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

1821
Patents

128.09496 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.10224 127.9
[M+Na]+ 151.08418 134.0
[M-H]- 127.08768 129.7
[M+NH4]+ 146.12878 150.1
[M+K]+ 167.05812 134.8
[M+H-H2O]+ 111.09222 122.5
[M+HCOO]- 173.09316 153.8
[M+CH3COO]- 187.10881 180.6
[M+Na-2H]- 149.06963 133.3
[M]+ 128.09441 128.1
[M]- 128.09551 128.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.