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3-Thiabicyclo[3.2.0]heptane-6,7-dicarboxylic acid, dimethyl ester, 3,3-dioxide, (1.alpha.,5.alpha.,6.alpha.,7.beta.)-(.+-.)-
SpectraBase Compound ID BUVbBHslSfr
InChI InChI=1S/C10H14O6S/c1-15-9(11)7-5-3-17(13,14)4-6(5)8(7)10(12)16-2/h5-8H,3-4H2,1-2H3/t5-,6+,7-,8-/m0/s1
InChIKey ZETDYEHBMHFWAY-YWIQKCBGSA-N
Mol Weight 262.28 g/mol
Molecular Formula C10H14O6S
Exact Mass 262.051109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DoIxBq85t8
Name 3-Thiabicyclo[3.2.0]heptane-6,7-dicarboxylic acid, dimethyl ester, 3,3-dioxide, (1.alpha.,5.alpha.,6.alpha.,7.beta.)-(.+-.)-
Alternate Name(s) Dimethyl (1R,5S,6R,7R)-3-thiabicyclo[3.2.0]heptane-6,7-dicarboxylate 3,3-dioxide trans-3,3-dioxo-3-thiabicyclo[3.2.0]heptane-6,7-dicarboxylic acid dimethyl ester
CAS Registry Number 99685-38-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O6S
InChI InChI=1S/C10H14O6S/c1-15-9(11)7-5-3-17(13,14)4-6(5)8(7)10(12)16-2/h5-8H,3-4H2,1-2H3/t5-,6+,7-,8-/m0/s1
InChIKey ZETDYEHBMHFWAY-YWIQKCBGSA-N
Molecular Weight 262.276 g/mol
SMILES C1S(C[C@@]2([C@@]([C@]([C@]12[H])(C(=O)OC)[H])(C(=O)OC)[H])[H])(=O)=O
SPLASH splash10-002b-9310000000-7081947793e9c32da6c0
Source of Spectrum J-50-5820-21
Wiley ID 1265237