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Methyl (5R*,6R*)-6-phenyl-2,3,5,6-tetrahydro-1,4-dithiocine-5-carboxylate
SpectraBase Compound ID GTCr2gGORLT
InChI InChI=1S/C14H16O2S2/c1-16-14(15)13-12(7-8-17-9-10-18-13)11-5-3-2-4-6-11/h2-8,12-13H,9-10H2,1H3/b8-7-/t12-,13-/m1/s1
InChIKey DILFYRNSPOMZBK-OTHLQRGRSA-N
Mol Weight 280.4 g/mol
Molecular Formula C14H16O2S2
Exact Mass 280.059172 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2t5n9kesEWv
Name Methyl (5R*,6R*)-6-phenyl-2,3,5,6-tetrahydro-1,4-dithiocine-5-carboxylate
Alternate Name(s) Methyl (5R,6R)-6-phenyl-2,3,5,6-tetrahydro-1,4-dithiocine-5-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O2S2
InChI InChI=1S/C14H16O2S2/c1-16-14(15)13-12(7-8-17-9-10-18-13)11-5-3-2-4-6-11/h2-8,12-13H,9-10H2,1H3/b8-7-/t12-,13-/m1/s1
InChIKey DILFYRNSPOMZBK-OTHLQRGRSA-N
Molecular Weight 280.400 g/mol
SMILES [C@]1([C@](\C=C/SCCS1)(c1ccccc1)[H])(C(=O)OC)[H]
SPLASH splash10-00kk-0940000000-8d5b7fb73992e185705b
Source of Spectrum F-62-3617-23
Wiley ID 1633002