CID 25202133

N,n-dihydroxy-l-valine

Structural Information

Molecular Formula
C5H11NO4
SMILES
CC(C)[C@@H](C(=O)O)N(O)O
InChI
InChI=1S/C5H11NO4/c1-3(2)4(5(7)8)6(9)10/h3-4,9-10H,1-2H3,(H,7,8)/t4-/m0/s1
InChIKey
VWRMUTKBDQWLAX-BYPYZUCNSA-N
Compound name
(2S)-2-(dihydroxyamino)-3-methylbutanoic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

149.0688 Da
Monoisotopic Mass

-2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.076076 130.8
[M+Na]+ 172.058018 136.0
[M-H]- 148.061524 128.6
[M+NH4]+ 167.102623 150.0
[M+K]+ 188.031958 137.4
[M+H-H2O]+ 132.066060 126.1
[M+HCOO]- 194.067001 150.1
[M+CH3COO]- 208.082651 174.7
[M+Na-2H]- 170.043466 132.4
[M]+ 149.06825142 129.5
[M]- 149.06934858 129.5
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

No patent data available for this compound.