CID 5719206

N'-(4-chloro-3-nitrobenzylidene)-2-(2-chlorophenoxy)acetohydrazide

Structural Information

Molecular Formula
C15H11Cl2N3O4
SMILES
C1=CC=C(C(=C1)OCC(=O)N/N=C/C2=CC(=C(C=C2)Cl)[N+](=O)[O-])Cl
InChI
InChI=1S/C15H11Cl2N3O4/c16-11-6-5-10(7-13(11)20(22)23)8-18-19-15(21)9-24-14-4-2-1-3-12(14)17/h1-8H,9H2,(H,19,21)/b18-8+
InChIKey
KCJRTLQIFFINCG-QGMBQPNBSA-N
Compound name
N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]-2-(2-chlorophenoxy)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

367.01266 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 368.01994 181.7
[M+Na]+ 390.00188 188.1
[M-H]- 366.00538 188.5
[M+NH4]+ 385.04648 194.2
[M+K]+ 405.97582 179.2
[M+H-H2O]+ 350.00992 179.2
[M+HCOO]- 412.01086 200.1
[M+CH3COO]- 426.02651 211.8
[M+Na-2H]- 387.98733 186.5
[M]+ 367.01211 185.7
[M]- 367.01321 185.7
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.