CID 13670209

Hexanoic acid, 1-(3-methoxy-3-oxopropyl)-2,2-dimethylhydrazide

Structural Information

Molecular Formula
C12H24N2O3
SMILES
CCCCCC(=O)N(CCC(=O)OC)N(C)C
InChI
InChI=1S/C12H24N2O3/c1-5-6-7-8-11(15)14(13(2)3)10-9-12(16)17-4/h5-10H2,1-4H3
InChIKey
YFJCLHJKVYSSBZ-UHFFFAOYSA-N
Compound name
methyl 3-[dimethylamino(hexanoyl)amino]propanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

244.1787 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.18598 161.7
[M+Na]+ 267.16792 165.3
[M-H]- 243.17142 164.0
[M+NH4]+ 262.21252 179.8
[M+K]+ 283.14186 167.5
[M+H-H2O]+ 227.17596 154.8
[M+HCOO]- 289.17690 185.8
[M+CH3COO]- 303.19255 206.5
[M+Na-2H]- 265.15337 162.1
[M]+ 244.17815 167.7
[M]- 244.17925 167.7
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

patents stripe