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trans-Dimethyl 2H-3,4-dihydro-1-benzothiopyran-2,3-dicarboxylate
SpectraBase Compound ID 1ddsfdEm6ok
InChI InChI=1S/C13H14O4S/c1-16-12(14)9-7-8-5-3-4-6-10(8)18-11(9)13(15)17-2/h3-6,9,11H,7H2,1-2H3/t9-,11-/m1/s1
InChIKey YFQWZMYVZAIBMB-MWLCHTKSSA-N
Mol Weight 266.31 g/mol
Molecular Formula C13H14O4S
Exact Mass 266.06128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IQKLGXNJXkB
Name trans-Dimethyl 2H-3,4-dihydro-1-benzothiopyran-2,3-dicarboxylate
Alternate Name(s) Dimethyl (2R,3S)-3,4-dihydro-2H-1-benzothiopyran-2,3-dicarboxylate
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Formula C13H14O4S
InChI InChI=1S/C13H14O4S/c1-16-12(14)9-7-8-5-3-4-6-10(8)18-11(9)13(15)17-2/h3-6,9,11H,7H2,1-2H3/t9-,11-/m1/s1
InChIKey YFQWZMYVZAIBMB-MWLCHTKSSA-N
Molecular Weight 266.311 g/mol
SMILES [C@]1([C@@](Sc2c(C1)cccc2)(C(=O)OC)[H])(C(=O)OC)[H]
SPLASH splash10-0002-0950000000-c38c036e2b282da0c508
Source of Spectrum SO-0-328-6
Wiley ID 873501