655147
2,4,6-Trichloroanisole-d5
98 atom % D
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About This Item
Linear Formula:
Cl3C6D2OCD3
CAS Number:
Molecular Weight:
216.50
NACRES:
NA.12
PubChem Substance ID:
UNSPSC Code:
41116107
MDL number:
Isotopic purity:
98 atom % D
Mass shift:
M+5
InChI
1S/C7H5Cl3O/c1-11-7-5(9)2-4(8)3-6(7)10/h2-3H,1H3/i1D3,2D,3D
SMILES string
[2H]c1c(Cl)c([2H])c(Cl)c(OC([2H])([2H])[2H])c1Cl
InChI key
WCVOGSZTONGSQY-RHIBPKLGSA-N
isotopic purity
98 atom % D
bp
132 °C/28 mmHg (lit.)
mp
60-62 °C (lit.)
format
neat
mass shift
M+5
Quality Level
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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.
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Warning
hcodes
pcodes
Hazard Classifications
Acute Tox. 4 Oral - Aquatic Chronic 4 - Eye Irrit. 2
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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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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