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Spiro[1,3-dithiolane-2,2'(1'H)-pentalene]-3'a,6'a(3'H,4'H)-dicarboxylic acid, dihydro-5'-oxo-, dimethyl ester, cis-
SpectraBase Compound ID Hlwlbf1NGI4
InChI InChI=1S/C14H18O5S2/c1-18-10(16)12-5-9(15)6-13(12,11(17)19-2)8-14(7-12)20-3-4-21-14/h3-8H2,1-2H3/t12-,13?/m0/s1
InChIKey LIWFKRBCISCZGR-UEWDXFNNSA-N
Mol Weight 330.41 g/mol
Molecular Formula C14H18O5S2
Exact Mass 330.059566 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GWGQ9zA2umr
Name Spiro[1,3-dithiolane-2,2'(1'H)-pentalene]-3'a,6'a(3'H,4'H)-dicarboxylic acid, dihydro-5'-oxo-, dimethyl ester, cis-
CAS Registry Number 91758-64-4
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O5S2
InChI InChI=1S/C14H18O5S2/c1-18-10(16)12-5-9(15)6-13(12,11(17)19-2)8-14(7-12)20-3-4-21-14/h3-8H2,1-2H3/t12-,13?/m0/s1
InChIKey LIWFKRBCISCZGR-UEWDXFNNSA-N
Molecular Weight 330.413 g/mol
SMILES [C@@]12(C(C(=O)OC)(CC3(C2)SCCS3)CC(C1)=O)C(=O)OC
SPLASH splash10-059t-7943000000-2e6af2019a280c809366
Source of Spectrum I-62-1190-0
Synonyms 3'a,6'a-dimethyl (6'aR)-5'-oxo-hexahydro-1'H-spiro[1,3-dithiolane-2,2'-pentalene]-3'a,6'a-dicarboxylate Dimethyl cis-3,3-ethylenedithio-7-oxobicyclo[3.3.0]octane-1,5-dicarboxylate
Wiley ID 1327499