CID 9666056

2-(2,3-dichlorophenoxy)-n'-(2-thienylmethylene)acetohydrazide

Structural Information

Molecular Formula
C13H10Cl2N2O2S
SMILES
C1=CC(=C(C(=C1)Cl)Cl)OCC(=O)N/N=C/C2=CC=CS2
InChI
InChI=1S/C13H10Cl2N2O2S/c14-10-4-1-5-11(13(10)15)19-8-12(18)17-16-7-9-3-2-6-20-9/h1-7H,8H2,(H,17,18)/b16-7+
InChIKey
CZQKPPQTRKAHDJ-FRKPEAEDSA-N
Compound name
2-(2,3-dichlorophenoxy)-N-[(E)-thiophen-2-ylmethylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

327.984 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 328.99128 172.7
[M+Na]+ 350.97322 181.7
[M-H]- 326.97672 180.8
[M+NH4]+ 346.01782 190.5
[M+K]+ 366.94716 175.5
[M+H-H2O]+ 310.98126 167.0
[M+HCOO]- 372.98220 186.6
[M+CH3COO]- 386.99785 207.1
[M+Na-2H]- 348.95867 173.4
[M]+ 327.98345 179.5
[M]- 327.98455 179.5
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.