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1,3-Dithiane-2-[13C]

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General Information
Catalog: BLP-005572
Molecular Formula: [13C]C3H8S2
Molecular Weight: 121.23

Chemical Structure

Description	1,3-Dithiane-2-[13C] is a 13C labelled 1,3-Dithiane. 1,3-Dithiane is a protected formaldehyde anion equivalent that could serve as a useful labelled synthon. 1,3-Dithiane is also a sulfur-containing Maillard reaction products (MRPs) found in boiled beef extracts. 1,3-Dithiane shows a potent direct-acting mutagenicity toward S. typhimurium TA98 and TA100.
Related CAS	505-23-7 (unlabelled)
Canonical SMILES	C1CSCSC1
InChI	InChI=1S/C4H8S2/c1-2-5-4-6-3-1/h1-4H2/i4+1D2
InChI Key	WQADWIOXOXRPLN-RCZUCQLYSA-N
Melting Point	52-54°C
Purity	≥98% by CP; 99% atom 13C
Appearance	White Powder