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Dimethyl (5R,6R)-1,3-dimethyl-4,5,6,7-tetrahydro-2-benzothiophene-5,6-dicarboxylate
SpectraBase Compound ID 8O8xRtuhVbI
InChI InChI=1S/C14H18O4S/c1-7-9-5-11(13(15)17-3)12(14(16)18-4)6-10(9)8(2)19-7/h11-12H,5-6H2,1-4H3/t11-,12-/m1/s1
InChIKey OILOBKCXYYUWEO-VXGBXAGGSA-N
Mol Weight 282.35 g/mol
Molecular Formula C14H18O4S
Exact Mass 282.09258 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JlBojqd1o4I
Name Dimethyl (5R,6R)-1,3-dimethyl-4,5,6,7-tetrahydro-2-benzothiophene-5,6-dicarboxylate
Alternate Name(s) (5R,6R)-1,3-dimethyl-4,5,6,7-tetrahydro-2-benzothiophene-5,6-dicarboxylic acid dimethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O4S
InChI InChI=1S/C14H18O4S/c1-7-9-5-11(13(15)17-3)12(14(16)18-4)6-10(9)8(2)19-7/h11-12H,5-6H2,1-4H3/t11-,12-/m1/s1
InChIKey OILOBKCXYYUWEO-VXGBXAGGSA-N
Molecular Weight 282.354 g/mol
SMILES c12c(c(C)sc2C)C[C@]([C@@](C1)(C(=O)OC)[H])(C(=O)OC)[H]
SPLASH splash10-03l0-0590000000-8b7d8ecff344b2d4648a
Source of Spectrum F-67-9274-9
Wiley ID 1571435