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Tebuconazol-(trimethyl-[13C3])

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General Information
Catalog: BLP-001279
CAS: 1313734-83-6
Molecular Formula: C13[13C]3H22ClN3O
Molecular Weight: 310.80

Chemical Structure

Description	Tebuconazol-(trimethyl-[13C3]) is an isotope form of Tebuconazole. Tebuconazole, a triazole compound, has been found to be an ergosterol biosynthesis inhibitor.
IUPAC Name	1-(4-chlorophenyl)-4,4-di((1-13C)methyl)-3-(1,2,4-triazol-1-ylmethyl)(5-13C)pentan-3-ol
Related CAS	107534-96-3 (unlabelled)
Canonical SMILES	CC(C)(C)C(CCC1=CC=C(C=C1)Cl)(CN2C=NC=N2)O
InChI	InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3/i1+1,2+1,3+1
InChI Key	PXMNMQRDXWABCY-VMIGTVKRSA-N
Purity	97% by CP; 99% atom 13C