CID 113519

2'-methyl-2'-(n-methylcarbamoyl)acrylohydrazide

Structural Information

Molecular Formula
C6H11N3O2
SMILES
CNC(=O)N(C)NC(=O)C=C
InChI
InChI=1S/C6H11N3O2/c1-4-5(10)8-9(3)6(11)7-2/h4H,1H2,2-3H3,(H,7,11)(H,8,10)
InChIKey
XJWYTCIPMDPJBB-UHFFFAOYSA-N
Compound name
1,3-dimethyl-1-(prop-2-enoylamino)urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.08513 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.092406 134.5
[M+Na]+ 180.074348 140.0
[M-H]- 156.077854 136.5
[M+NH4]+ 175.118953 155.1
[M+K]+ 196.048288 141.2
[M+H-H2O]+ 140.082390 128.5
[M+HCOO]- 202.083331 160.9
[M+CH3COO]- 216.098981 185.7
[M+Na-2H]- 178.059796 138.8
[M]+ 157.08458142 133.7
[M]- 157.08567858 133.7
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.