Bicyclo[2.2.1]heptane-1-methanesulfonic acid, 7,7-dimethyl-2-oxo-, hexahydrospiro[1,3-dioxolane-2,2'(1'H)-pentalen]-5'-yl ester, stereoisomer

SpectraBase Compound ID	4PmGW7JSRd5
InChI	InChI=1S/C20H30O6S/c1-18(2)15-3-4-19(18,17(21)9-15)12-27(22,23)26-16-7-13-10-20(11-14(13)8-16)24-5-6-25-20/h13-16H,3-12H2,1-2H3/t13-,14+,15-,16-,19-/m0/s1
InChIKey	DDJZKAOGRJYQFB-SPCJURDBSA-N Google Search
Mol Weight	398.51 g/mol
Molecular Formula	C20H30O6S
Exact Mass	398.17631 g/mol

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SpectraBase Spectrum ID	6GBvTXDz17l
Name	Bicyclo[2.2.1]heptane-1-methanesulfonic acid, 7,7-dimethyl-2-oxo-, hexahydrospiro[1,3-dioxolane-2,2'(1'H)-pentalen]-5'-yl ester, stereoisomer
CAS Registry Number	116115-51-6
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C20H30O6S
InChI	InChI=1S/C20H30O6S/c1-18(2)15-3-4-19(18,17(21)9-15)12-27(22,23)26-16-7-13-10-20(11-14(13)8-16)24-5-6-25-20/h13-16H,3-12H2,1-2H3/t13-,14+,15-,16-,19-/m0/s1
InChIKey	DDJZKAOGRJYQFB-SPCJURDBSA-N
Molecular Weight	398.514 g/mol
SMILES	[C@@]12(C([C@@](CC2)(CC1=O)[H])(C)C)CS(O[C@]1(C[C@]2(CC3(C[C@]2(C1)[H])OCCO3)[H])[H])(=O)=O
SPLASH	splash10-014i-0900000000-f6cbfc69e41cfab28979
Source of Spectrum	KC-1990-1666-1
Synonyms	Spiro[1,3-dioxolane-2,2'(1'H)-pentalene], bicyclo[2.2.1]heptane-1-methanesulfonic acid deriv. (3'aR,5'S,6'aS)-hexahydro-1'H-spiro[1,3-dioxolane-2,2'-pentalene]-5'-yl {7,7-dimethyl-2-oxobicyclo[2.2.1]heptan-1-yl}methanesulfonate 3.alpha.-[(+)-Canporsulphonyloxy]-7,7-ethylenedioxy-1.beta.,5.beta.-bicyclo[3.3.0]octane
Wiley ID	1368306