For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(2R,3R,4S)-4-Dimethylamino-6-thiophen-2-yl-3,4-dihydro-2H-thiopyran-2,3-dicarboxylic acid
SpectraBase Compound ID 1vFMLSctbCl
InChI InChI=1S/C13H15NO4S2/c1-14(2)7-6-9(8-4-3-5-19-8)20-11(13(17)18)10(7)12(15)16/h3-7,10-11H,1-2H3,(H,15,16)(H,17,18)/t7-,10+,11-/m1/s1
InChIKey COVKKHFCGVFZCM-PPKCKEKNSA-N
Mol Weight 313.39 g/mol
Molecular Formula C13H15NO4S2
Exact Mass 313.04425 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID I9pTxH4Mf0e
Name (2R,3R,4S)-4-Dimethylamino-6-thiophen-2-yl-3,4-dihydro-2H-thiopyran-2,3-dicarboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO4S2
InChI InChI=1S/C13H15NO4S2/c1-14(2)7-6-9(8-4-3-5-19-8)20-11(13(17)18)10(7)12(15)16/h3-7,10-11H,1-2H3,(H,15,16)(H,17,18)/t7-,10+,11-/m1/s1
InChIKey COVKKHFCGVFZCM-PPKCKEKNSA-N
Molecular Weight 313.386 g/mol
SMILES OC([C@]1([C@@](C(=O)O)([C@@](C=C(S1)c1sccc1)(N(C)C)[H])[H])[H])=O
SPLASH splash10-00di-1390000000-10ed6a6fa2a619eb5d67
Source of Spectrum AH-132-955-10
Synonyms (3SR)-4-(Dimethylamino)-6-(2'-thienyl)-3,4-dihydro-2H-thiopyran-2,3-dicarboxylic acid 2,6-anhydro-3-carboxy-3,4,5-trideoxy-4-(dimethylamino)-6-(2-thienyl)-2-thio-D-xylo-hex-5-enonic acid (2R,3R,4S)-4-(dimethylamino)-6-thiophen-2-yl-3,4-dihydro-2H-thiopyran-2,3-dicarboxylic acid
Wiley ID 849854