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Key Documents

655147

Sigma-Aldrich

2,4,6-Trichloroanisole-d5

98 atom % D

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About This Item

Linear Formula:
Cl3C6D2OCD3
CAS Number:
Molecular Weight:
216.50
MDL number:
UNSPSC Code:
41116107
PubChem Substance ID:
NACRES:
NA.12

isotopic purity

98 atom % D

Quality Level

bp

132 °C/28 mmHg (lit.)

mp

60-62 °C (lit.)

format

neat

mass shift

M+5

SMILES string

[2H]c1c(Cl)c([2H])c(Cl)c(OC([2H])([2H])[2H])c1Cl

InChI

1S/C7H5Cl3O/c1-11-7-5(9)2-4(8)3-6(7)10/h2-3H,1H3/i1D3,2D,3D

InChI key

WCVOGSZTONGSQY-RHIBPKLGSA-N

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Application

This product may be used as an analytical standard.

Packaging

This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

Pictograms

Exclamation mark

Signal Word

Warning

Hazard Statements

Precautionary Statements

Hazard Classifications

Acute Tox. 4 Oral - Aquatic Chronic 4 - Eye Irrit. 2

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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Navideh Sadoughi et al.
Journal of agricultural and food chemistry, 63(11), 2877-2885 (2015-02-24)
An optimized method for the quantitation of volatile compounds responsible for off-aromas, such as earthy odors, found in wine and grapes was developed. The method involved a fast and simple headspace solid-phase microextraction-gas chromatography-mass spectrometry (HS-SPME-GC-MS) for simultaneous determination of

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