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Product Overview

Product Code

TRC-N650500

CAS Number

4674-50-4

Product Format

Neat

Regulatory Method

EPA Biopesticide Active Ingredients

Molecular Formula

C15 H22 O

Molecular Weight

218.33

Product Categories

TRC, Food additives, flavours and adulterants, Pesticide & Metabolite Reference Materials and Research Chemicals , Pesticide and Metabolite Reference Materials , Pharmaceutical Toxicology Reference Materials

Product Type

Contaminant

Documentation

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Product Information

Chemical Data

Analyte Name

Nootkatone

CAS Number

4674-50-4

Molecular Formula

C15 H22 O

Molecular Weight

218.33

Accurate Mass

218.1671

SMILES

C[C@@H]1CC(=O)C=C2CC[C@H](C[C@@]12C)C(=C)C

InChI

InChI=1S/C15H22O/c1-10(2)12-5-6-13-8-14(16)7-11(3)15(13,4)9-12/h8,11-12H,1,5-7,9H2,2-4H3/t11-,12-,15+/m1/s1

IUPAC

(4R,4aS,6R)-4,4a-dimethyl-6-prop-1-en-2-yl-3,4,5,6,7,8-hexahydronaphthalen-2-one

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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