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Product Overview

Product Code

TRC-C441985

CAS Number

121-20-0

Product Format

Neat

Molecular Formula

C21 H28 O5

Molecular Weight

360.44

Product Categories

Insecticides and metabolites, Insecticides and metabolites, Extracts, TRC, Pharmaceutical Toxicology Reference Materials

Product Type

Contaminant

Analytical Method

HPLC

Documentation

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Product Information

Chemical Data

Analyte Name

Cinerin II

CAS Number

121-20-0

Molecular Formula

C21 H28 O5

Molecular Weight

360.44

Accurate Mass

360.1937

Flash Point

SMILES

COC(=O)\C(=C\[C@@H]1[C@@H](C(=O)O[C@H]2CC(=O)C(=C2C)C\C=C/C)C1(C)C)\C

InChI

InChI=1S/C21H28O5/c1-7-8-9-14-13(3)17(11-16(14)22)26-20(24)18-15(21(18,4)5)10-12(2)19(23)25-6/h7-8,10,15,17-18H,9,11H2,1-6H3/b8-7-,12-10+/t15-,17+,18+/m1/s1

IUPAC

[(1S)-3-[(Z)-but-2-enyl]-2-methyl-4-oxocyclopent-2-en-1-yl] (1R,3R)-3-[(E)-3-methoxy-2-methyl-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

Analytical Method

HPLC

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