CID 536690

2-amino-3-hydroxy-2-methylbutanoic acid hydrochloride

Structural Information

Molecular Formula
C5H11NO3
SMILES
CC(C(C)(C(=O)O)N)O
InChI
InChI=1S/C5H11NO3/c1-3(7)5(2,6)4(8)9/h3,7H,6H2,1-2H3,(H,8,9)
InChIKey
NWZTXAMTDLRLFP-UHFFFAOYSA-N
Compound name
2-amino-3-hydroxy-2-methylbutanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

133.0739 Da
Monoisotopic Mass

-3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.08118 127.1
[M+Na]+ 156.06312 133.8
[M+NH4]+ 151.10772 132.8
[M+K]+ 172.03706 132.8
[M-H]- 132.06662 123.8
[M+Na-2H]- 154.04857 128.1
[M]+ 133.07335 126.6
[M]- 133.07445 126.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

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