CID 9558030

2-(2-chlorophenoxy)-n'-(4-(dimethylamino)benzylidene)acetohydrazide

Structural Information

Molecular Formula
C17H18ClN3O2
SMILES
CN(C)C1=CC=C(C=C1)/C=N/NC(=O)COC2=CC=CC=C2Cl
InChI
InChI=1S/C17H18ClN3O2/c1-21(2)14-9-7-13(8-10-14)11-19-20-17(22)12-23-16-6-4-3-5-15(16)18/h3-11H,12H2,1-2H3,(H,20,22)/b19-11+
InChIKey
USHJCVYMQBWSAU-YBFXNURJSA-N
Compound name
2-(2-chlorophenoxy)-N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

331.10876 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 332.116036 178.1
[M+Na]+ 354.097978 184.2
[M-H]- 330.101484 187.1
[M+NH4]+ 349.142583 193.0
[M+K]+ 370.071918 180.5
[M+H-H2O]+ 314.106020 169.4
[M+HCOO]- 376.106961 201.7
[M+CH3COO]- 390.122611 219.7
[M+Na-2H]- 352.083426 182.1
[M]+ 331.10821142 183.0
[M]- 331.10930858 183.0
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.