CID 348089

2-acetamido-3-hydroxy-2-methylpropanoic acid

Structural Information

Molecular Formula
C6H11NO4
SMILES
CC(=O)NC(C)(CO)C(=O)O
InChI
InChI=1S/C6H11NO4/c1-4(9)7-6(2,3-8)5(10)11/h8H,3H2,1-2H3,(H,7,9)(H,10,11)
InChIKey
ZORCAFBRVKRMLT-UHFFFAOYSA-N
Compound name
2-acetamido-3-hydroxy-2-methylpropanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

161.0688 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.07608 133.0
[M+Na]+ 184.05802 138.9
[M-H]- 160.06152 130.7
[M+NH4]+ 179.10262 151.9
[M+K]+ 200.03196 138.9
[M+H-H2O]+ 144.06606 128.8
[M+HCOO]- 206.06700 152.6
[M+CH3COO]- 220.08265 174.5
[M+Na-2H]- 182.04347 137.5
[M]+ 161.06825 132.1
[M]- 161.06935 132.1
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