CID 9589069

Benzeneacetic acid, alpha-hydroxy-alpha-methyl-, (1-(2-chlorophenyl)ethylidene)hydrazide, (e)-

Structural Information

Molecular Formula

C₁₇H₁₇ClN₂O₂

SMILES

C/C(=N\NC(=O)C(C)(C1=CC=CC=C1)O)/C2=CC=CC=C2Cl

InChI

InChI=1S/C17H17ClN2O2/c1-12(14-10-6-7-11-15(14)18)19-20-16(21)17(2,22)13-8-4-3-5-9-13/h3-11,22H,1-2H3,(H,20,21)/b19-12+

InChIKey

KCZUHFLXVBUZHB-XDHOZWIPSA-N

Compound name

N-[(E)-1-(2-chlorophenyl)ethylideneamino]-2-hydroxy-2-phenylpropanamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 316.09787 Da
Monoisotopic Mass: 3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	317.105146	173.2
[M+Na]+	339.087088	178.9
[M-H]-	315.090594	179.6
[M+NH4]+	334.131693	187.5
[M+K]+	355.061028	174.0
[M+H-H2O]+	299.095130	166.1
[M+HCOO]-	361.096071	191.3
[M+CH3COO]-	375.111721	208.9
[M+Na-2H]-	337.072536	177.6
[M]+	316.09732142	174.2
[M]-	316.09841858	174.2

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.