CID 5708313

28663-68-5

Structural Information

Molecular Formula
C10H11ClN2O2
SMILES
CCOC(=O)/C(=N/NC1=CC=CC=C1)/Cl
InChI
InChI=1S/C10H11ClN2O2/c1-2-15-10(14)9(11)13-12-8-6-4-3-5-7-8/h3-7,12H,2H2,1H3/b13-9-
InChIKey
LZCJYKSOIZQABU-LCYFTJDESA-N
Compound name
ethyl (2Z)-2-chloro-2-(phenylhydrazinylidene)acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

226.0509 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.058176 148.0
[M+Na]+ 249.040118 154.6
[M-H]- 225.043624 152.7
[M+NH4]+ 244.084723 166.8
[M+K]+ 265.014058 152.0
[M+H-H2O]+ 209.048160 141.9
[M+HCOO]- 271.049101 170.2
[M+CH3COO]- 285.064751 193.2
[M+Na-2H]- 247.025566 153.8
[M]+ 226.05035142 150.8
[M]- 226.05144858 150.8
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.