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Substance Name: 3-Pyridinecarboxaldehyde, 1,2,5,6-tetrahydro-1-methyl-, O-2-butenyloxime, monohydrochloride, (E,E)-
RN: 139886-26-3
InChIKey: MBQYVWAACFLRSI-ALRXLZRNSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H18-N2-O.Cl-H

Molecular Weight

  • 230.7371
 
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Names and Synonyms

Synonym

  • 1-Methyl-1,2,5,6-tetrahydropyridine-3-carboxaldehyde-O-2-butenyloxime hydrochloride

Systematic Name

  • 3-Pyridinecarboxaldehyde, 1,2,5,6-tetrahydro-1-methyl-, O-2-butenyloxime, monohydrochloride, (E,E)-

Registry Numbers

CAS Registry Number

  • 139886-26-3

System Generated Number

  • 0139886263

Molecular Formulas

Molecular Formula

  • C11-H18-N2-O.Cl-H

Molecular Formula Fragments

  • C11-H18-N2-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C11H18N2O.ClH/c1-3-4-8-14-12-9-11-6-5-7-13(2)10-11;/h3-4,6,9H,5,7-8,10H2,1-2H3;1H/b4-3+,12-9+;

InChIKey

MBQYVWAACFLRSI-ALRXLZRNSA-N

Smiles

C/C=C/CO/N=C/C1=CCCN(C1)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 250mg/kg (250mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 26, Pg. 853, 1991.