CID 3024687

Propanoic acid, 3-(2,2-dimethyl-1-((methylamino)carbonyl)hydrazino)-, ethyl ester

Structural Information

Molecular Formula
C9H19N3O3
SMILES
CCOC(=O)CCN(C(=O)NC)N(C)C
InChI
InChI=1S/C9H19N3O3/c1-5-15-8(13)6-7-12(11(3)4)9(14)10-2/h5-7H2,1-4H3,(H,10,14)
InChIKey
GXVMJEXLNAXRSO-UHFFFAOYSA-N
Compound name
ethyl 3-[dimethylamino(methylcarbamoyl)amino]propanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

217.14264 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.14992 152.1
[M+Na]+ 240.13186 156.1
[M-H]- 216.13536 154.9
[M+NH4]+ 235.17646 170.9
[M+K]+ 256.10580 159.1
[M+H-H2O]+ 200.13990 145.1
[M+HCOO]- 262.14084 178.1
[M+CH3COO]- 276.15649 202.0
[M+Na-2H]- 238.11731 154.2
[M]+ 217.14209 155.9
[M]- 217.14319 155.9
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