CID 4478048

N-hydroxyl-l-tyrosine

Structural Information

Molecular Formula
C9H11NO4
SMILES
C1=CC(=CC=C1CC(C(=O)O)NO)O
InChI
InChI=1S/C9H11NO4/c11-7-3-1-6(2-4-7)5-8(10-14)9(12)13/h1-4,8,10-11,14H,5H2,(H,12,13)
InChIKey
CNIUEVQJABPUIJ-UHFFFAOYSA-N
Compound name
2-(hydroxyamino)-3-(4-hydroxyphenyl)propanoic acid
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

9
References

1199
Patents

197.0688 Da
Monoisotopic Mass

-1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.07608 141.4
[M+Na]+ 220.05802 150.2
[M+NH4]+ 215.10262 147.2
[M+K]+ 236.03196 147.4
[M-H]- 196.06152 140.7
[M+Na-2H]- 218.04347 145.0
[M]+ 197.06825 142.0
[M]- 197.06935 142.0
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

patents stripe