CID 51060930

3,4-dichloro-n-(2-(2-(3-hydroxybenzylidene)hydrazino)-2-oxoethyl)benzamide

Structural Information

Molecular Formula
C16H13Cl2N3O3
SMILES
C1=CC(=CC(=C1)O)/C=N/NC(=O)CNC(=O)C2=CC(=C(C=C2)Cl)Cl
InChI
InChI=1S/C16H13Cl2N3O3/c17-13-5-4-11(7-14(13)18)16(24)19-9-15(23)21-20-8-10-2-1-3-12(22)6-10/h1-8,22H,9H2,(H,19,24)(H,21,23)/b20-8+
InChIKey
YEGAKHVQZMOLQM-DNTJNYDQSA-N
Compound name
3,4-dichloro-N-[2-[(2E)-2-[(3-hydroxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

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References

0
Patents

365.0334 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 366.04068 181.2
[M+Na]+ 388.02262 193.3
[M+NH4]+ 383.06722 187.5
[M+K]+ 403.99656 186.1
[M-H]- 364.02612 185.2
[M+Na-2H]- 386.00807 188.1
[M]+ 365.03285 184.3
[M]- 365.03395 184.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.