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


45-613150-1G	1 g	$973.00 1/EAAdd To Favorites	Add To Favorites

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
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