CID 20836238

N-methyl-3-(methylamino)-2-butenamide

Structural Information

Molecular Formula
C6H12N2O
SMILES
C/C(=C/C(=O)NC)/NC
InChI
InChI=1S/C6H12N2O/c1-5(7-2)4-6(9)8-3/h4,7H,1-3H3,(H,8,9)/b5-4-
InChIKey
QDEUCPLXUDTYOV-PLNGDYQASA-N
Compound name
(Z)-N-methyl-3-(methylamino)but-2-enamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

1
Patents

128.09496 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.102236 128.9
[M+Na]+ 151.084178 134.6
[M-H]- 127.087684 129.3
[M+NH4]+ 146.128783 150.4
[M+K]+ 167.058118 134.5
[M+H-H2O]+ 111.092220 123.7
[M+HCOO]- 173.093161 153.3
[M+CH3COO]- 187.108811 177.3
[M+Na-2H]- 149.069626 133.7
[M]+ 128.09441142 127.0
[M]- 128.09550858 127.0
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.