CID 9570386

4-chlorophenylglyoxal n,n-diethylhydrazone

Structural Information

Molecular Formula
C12H15ClN2O
SMILES
CCN(CC)/N=C/C(=O)C1=CC=C(C=C1)Cl
InChI
InChI=1S/C12H15ClN2O/c1-3-15(4-2)14-9-12(16)10-5-7-11(13)8-6-10/h5-9H,3-4H2,1-2H3/b14-9+
InChIKey
LVHCUONWHLDNDW-NTEUORMPSA-N
Compound name
(2E)-1-(4-chlorophenyl)-2-(diethylhydrazinylidene)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.0873 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.09458 153.9
[M+Na]+ 261.07652 161.0
[M-H]- 237.08002 160.0
[M+NH4]+ 256.12112 173.3
[M+K]+ 277.05046 158.3
[M+H-H2O]+ 221.08456 147.5
[M+HCOO]- 283.08550 176.6
[M+CH3COO]- 297.10115 201.6
[M+Na-2H]- 259.06197 158.3
[M]+ 238.08675 158.4
[M]- 238.08785 158.4
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.