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3-(Trimethylsilyl)-1-propanesulfonic acid-d6 sodium salt

ALDRICH/613150 - 98 atom % D

Synonym: 2,2-Dimethyl-2-silapentane-5-sulfonate-d6 sodium salt; DSS-d6; Deuterated 3-(trimethylsilyl)-1-propanesulfonic acid sodium salt; Sodium 2-(trimethylsilyl)-1-propanesulfonate-d6

CAS Number: 284664-85-3
Empirical Formula (Hill Notation): C6D6H9NaO3SSi
Molecular Weight: 224.36
MDL Number: MFCD03701634
Linear Formula: (CH3)3Si(CD2)3SO3Na
Product Type: Chemical
Catalog Number PKG Qty. Price Quantity
45-613150-1G 1 g
 $1040.00
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This picture is provided solely for illustration purposes. Optical properties of the actual product may deviate. Relevant product information is printed on labeled products and other accompanying or available information material. This image depicts SKU: 613150-1G

 

form solid
InChI 1S/C6H16O3SSi.Na/c1-11(2,3)6-4-5-10(7,8)9;/h4-6H2,1-3H3,(H,7,8,9);/q;+1/p-1/i4D2,5D2,6D2;
InChI key HWEXKRHYVOGVDA-CHBZFOKHSA-M
isotopic purity 98 atom % D
mass shift M+6
mp 118-120 °C (lit.)
Quality Level 200 
SMILES string [Na+].[2H]C([2H])(C([2H])([2H])[Si](C)(C)C)C([2H])([2H])S([O-])(=O)=O
storage temp. room temp
technique(s) bio NMR: suitable
  NMR: suitable
Application: In exometabolome analysis using 1H-NMR (nuclear magnetic resonance) spectroscopy, 3-(Trimethylsilyl)-1-propanesulfonic acid-d6 sodium salt has been used as an internal standard for metabolite quantification. It has been used for the preparation of DMSO (dimethyl sulfoxide)/DSS solvent solution to make NMR leaf extract samples.
General description: 3-(Trimethylsilyl)-1-propanesulfonic acid (also referred to as DSS (2,2-Dimethyl-2-silapentane-5-sulfonate)) is an internal standard for NMR (nuclear magnetic resonance) studies. It results in high intensity proton peaks which are easily identified. DSS also has negligible sensitivity towards pH and temperature changes.
Packaging: 5×0.5, 1 g in glass bottle
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 .
RIDADR NONH for all modes of transport
WGK Germany WGK 3
mp 118-120 °C (lit.)
Storage Temp. room temp
UNSPSC 12352106

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