Skip to Content
Merck
CN

613150

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

98 atom % D

Synonym(s):

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

Sign In to View Organizational & Contract Pricing.

Select a Size

About This Item

Linear Formula:
(CH3)3Si(CD2)3SO3Na
CAS Number:
284664-85-3
Molecular Weight:
224.36
NACRES:
NA.11
PubChem Substance ID:
24882112
UNSPSC Code:
12352106
MDL number:
MFCD03701634
Isotopic purity:
98 atom % D
Mass shift:
M+6
Form:
solid

Key Documents

View All Documentation
Technical Service
Need help? Our team of experienced scientists is here for you.
Let Us Assist
Technical Service
Need help? Our team of experienced scientists is here for you.
Let Us Assist

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;

SMILES string

[Na+].[2H]C([2H])(C([2H])([2H])[Si](C)(C)C)C([2H])([2H])S([O-])(=O)=O

InChI key

HWEXKRHYVOGVDA-CHBZFOKHSA-M

isotopic purity

98 atom % D

form

solid

technique(s)

NMR: suitable, bio NMR: suitable

mp

118-120 °C (lit.)

mass shift

M+6

storage temp.

room temp

Quality Level

200

Related Categories

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.

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.

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.

Storage Class

11 - Combustible Solids

wgk

WGK 3

Regulatory Information

美国出口管控产品
This item has

Choose from one of the most recent versions:

Certificates of Analysis (COA)

Lot/Batch Number
MBBD7313
MBBD3981
MBBC8579
MBBB0476V
EB1191

Don't see the Right Version?

If you require a particular version, you can look up a specific certificate by the Lot or Batch number.

Search for a COA

Already Own This Product?

Find documentation for the products that you have recently purchased in the Document Library.

Visit the Document Library

Annual Reports on NMR Spectroscopy (2009)
DSA: a new internal standard for NMR studies in aqueous solution.
Nowick JS, et al.
Organic Letters, 5, 3511-3513 (2003)
Norio Kitadai et al.
Science advances, 5(6), eaav7848-eaav7848 (2019-06-22)
One of the most plausible scenarios of the origin of life assumes the preceding prebiotic autotrophic metabolism in sulfide-rich hydrothermal vent environments. However, geochemical mechanisms to harness the reductive power provided by hydrothermal systems remain to be elucidated. Here, we
Distinguishing Vaccinium species by chemical fingerprinting based on NMR spectra, validated with spectra collected in different laboratories.
Markus MA, et al.
Planta Medica, 80, 732-739 (2014)
Hunter N B Moseley et al.
BMC biology, 9, 37-37 (2011-06-02)
Stable isotope tracing is a powerful technique for following the fate of individual atoms through metabolic pathways. Measuring isotopic enrichment in metabolites provides quantitative insights into the biosynthetic network and enables flux analysis as a function of external perturbations. NMR
View All Related Papers

Related Content

Our team of scientists has experience in all areas of research including Life Science, Material Science, Chemical Synthesis, Chromatography, Analytical and many others.

Contact Technical Service