CID 20246401

(2e)-n-methyl-4-(methylamino)but-2-enamide hydrochloride

Structural Information

Molecular Formula
C6H12N2O
SMILES
CNC/C=C/C(=O)NC
InChI
InChI=1S/C6H12N2O/c1-7-5-3-4-6(9)8-2/h3-4,7H,5H2,1-2H3,(H,8,9)/b4-3+
InChIKey
SSAOOCFCVBMXIA-ONEGZZNKSA-N
Compound name
(E)-N-methyl-4-(methylamino)but-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

128.09496 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.102236 128.1
[M+Na]+ 151.084178 134.1
[M-H]- 127.087684 128.4
[M+NH4]+ 146.128783 149.7
[M+K]+ 167.058118 133.5
[M+H-H2O]+ 111.092220 122.9
[M+HCOO]- 173.093161 153.6
[M+CH3COO]- 187.108811 176.4
[M+Na-2H]- 149.069626 134.3
[M]+ 128.09441142 126.9
[M]- 128.09550858 126.9
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

patents stripe