CID 9608167

2-(2,3-dichlorophenoxy)-n'-(2-(trifluoromethyl)benzylidene)acetohydrazide

Structural Information

Molecular Formula
C16H11Cl2F3N2O2
SMILES
C1=CC=C(C(=C1)/C=N/NC(=O)COC2=C(C(=CC=C2)Cl)Cl)C(F)(F)F
InChI
InChI=1S/C16H11Cl2F3N2O2/c17-12-6-3-7-13(15(12)18)25-9-14(24)23-22-8-10-4-1-2-5-11(10)16(19,20)21/h1-8H,9H2,(H,23,24)/b22-8+
InChIKey
WGRVZOLIBZCYAP-GZIVZEMBSA-N
Compound name
2-(2,3-dichlorophenoxy)-N-[(E)-[2-(trifluoromethyl)phenyl]methylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

390.01495 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 391.02223 182.3
[M+Na]+ 413.00417 191.7
[M-H]- 389.00767 185.9
[M+NH4]+ 408.04877 195.4
[M+K]+ 428.97811 184.6
[M+H-H2O]+ 373.01221 173.0
[M+HCOO]- 435.01315 195.0
[M+CH3COO]- 449.02880 221.3
[M+Na-2H]- 410.98962 184.9
[M]+ 390.01440 184.4
[M]- 390.01550 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.