CID 45055108

2-(2,3-dichlorophenoxy)-n'-(4-(dimethylamino)benzylidene)acetohydrazide

Structural Information

Molecular Formula
C17H17Cl2N3O2
SMILES
CN(C)C1=CC=C(C=C1)/C=N/NC(=O)COC2=C(C(=CC=C2)Cl)Cl
InChI
InChI=1S/C17H17Cl2N3O2/c1-22(2)13-8-6-12(7-9-13)10-20-21-16(23)11-24-15-5-3-4-14(18)17(15)19/h3-10H,11H2,1-2H3,(H,21,23)/b20-10+
InChIKey
PBIQOKASVCIHGD-KEBDBYFISA-N
Compound name
2-(2,3-dichlorophenoxy)-N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

365.0698 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 366.07708 185.1
[M+Na]+ 388.05902 192.6
[M-H]- 364.06252 193.7
[M+NH4]+ 383.10362 199.4
[M+K]+ 404.03296 187.6
[M+H-H2O]+ 348.06706 177.5
[M+HCOO]- 410.06800 203.6
[M+CH3COO]- 424.08365 224.9
[M+Na-2H]- 386.04447 187.5
[M]+ 365.06925 191.8
[M]- 365.07035 191.8
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.