CID 165905220

2-methyl-3-[methyl(nitroso)amino]propanoic acid

Structural Information

Molecular Formula
C5H10N2O3
SMILES
CC(CN(C)N=O)C(=O)O
InChI
InChI=1S/C5H10N2O3/c1-4(5(8)9)3-7(2)6-10/h4H,3H2,1-2H3,(H,8,9)
InChIKey
RUJKVOHTKUJZBV-UHFFFAOYSA-N
Compound name
2-methyl-3-[methyl(nitroso)amino]propanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

146.06914 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 147.07642 128.7
[M+Na]+ 169.05836 134.8
[M-H]- 145.06186 130.7
[M+NH4]+ 164.10296 149.8
[M+K]+ 185.03230 137.3
[M+H-H2O]+ 129.06640 123.1
[M+HCOO]- 191.06734 154.5
[M+CH3COO]- 205.08299 183.3
[M+Na-2H]- 167.04381 133.5
[M]+ 146.06859 130.8
[M]- 146.06969 130.8
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.