CID 9644451

2-(2,3-dichlorophenoxy)-n'-(3-phenyl-2-propenylidene)acetohydrazide

Structural Information

Molecular Formula
C17H14Cl2N2O2
SMILES
C1=CC=C(C=C1)/C=C/C=N/NC(=O)COC2=C(C(=CC=C2)Cl)Cl
InChI
InChI=1S/C17H14Cl2N2O2/c18-14-9-4-10-15(17(14)19)23-12-16(22)21-20-11-5-8-13-6-2-1-3-7-13/h1-11H,12H2,(H,21,22)/b8-5+,20-11+
InChIKey
DWVHBDYXGWTFTL-JNJFRLMHSA-N
Compound name
2-(2,3-dichlorophenoxy)-N-[(E)-[(E)-3-phenylprop-2-enylidene]amino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

348.04324 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.050516 179.5
[M+Na]+ 371.032458 187.3
[M-H]- 347.035964 186.4
[M+NH4]+ 366.077063 194.0
[M+K]+ 387.006398 180.2
[M+H-H2O]+ 331.040500 172.3
[M+HCOO]- 393.041441 196.8
[M+CH3COO]- 407.057091 214.0
[M+Na-2H]- 369.017906 183.0
[M]+ 348.04269142 184.4
[M]- 348.04378858 184.4
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.