CID 91873155

N-benzoyl-l-tyrosine hydrazide

Structural Information

Molecular Formula
C16H17N3O3
SMILES
C1=CC=C(C=C1)C(=O)N[C@@H](CC2=CC=C(C=C2)O)C(=O)NN
InChI
InChI=1S/C16H17N3O3/c17-19-16(22)14(10-11-6-8-13(20)9-7-11)18-15(21)12-4-2-1-3-5-12/h1-9,14,20H,10,17H2,(H,18,21)(H,19,22)/t14-/m0/s1
InChIKey
CUDSVYDXQQXCSB-AWEZNQCLSA-N
Compound name
N-[(2S)-1-hydrazinyl-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

299.12698 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.13426 168.7
[M+Na]+ 322.11620 171.8
[M-H]- 298.11970 173.2
[M+NH4]+ 317.16080 181.1
[M+K]+ 338.09014 168.7
[M+H-H2O]+ 282.12424 160.1
[M+HCOO]- 344.12518 191.3
[M+CH3COO]- 358.14083 207.6
[M+Na-2H]- 320.10165 171.1
[M]+ 299.12643 164.7
[M]- 299.12753 164.7
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.