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]+ 300.134256 168.7
[M+Na]+ 322.116198 171.8
[M-H]- 298.119704 173.2
[M+NH4]+ 317.160803 181.1
[M+K]+ 338.090138 168.7
[M+H-H2O]+ 282.124240 160.1
[M+HCOO]- 344.125181 191.3
[M+CH3COO]- 358.140831 207.6
[M+Na-2H]- 320.101646 171.1
[M]+ 299.12643142 164.7
[M]- 299.12752858 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.