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Bicyclo[2.2.1]heptane-1-methanesulfonic acid, 2-(methoxymethoxy)-7,7-dimethyl-, octahydro-5-[(2-methoxyethoxy)methoxy]-2-pentalenyl ester, stereoisomer
SpectraBase Compound ID H2WkWE40BsN
InChI InChI=1S/C24H42O8S/c1-23(2)19-5-6-24(23,22(13-19)31-15-28-4)14-33(25,26)32-21-11-17-9-20(10-18(17)12-21)30-16-29-8-7-27-3/h17-22H,5-16H2,1-4H3/t17-,18+,19-,20-,21+,22-,24-/m0/s1
InChIKey JTLWXBWOSYGNQS-BYNLTHCKSA-N
Mol Weight 490.7 g/mol
Molecular Formula C24H42O8S
Exact Mass 490.260039 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6cfQZCM454L
Name Bicyclo[2.2.1]heptane-1-methanesulfonic acid, 2-(methoxymethoxy)-7,7-dimethyl-, octahydro-5-[(2-methoxyethoxy)methoxy]-2-pentalenyl ester, stereoisomer
CAS Registry Number 116115-53-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H42O8S
InChI InChI=1S/C24H42O8S/c1-23(2)19-5-6-24(23,22(13-19)31-15-28-4)14-33(25,26)32-21-11-17-9-20(10-18(17)12-21)30-16-29-8-7-27-3/h17-22H,5-16H2,1-4H3/t17-,18+,19-,20-,21+,22-,24-/m0/s1
InChIKey JTLWXBWOSYGNQS-BYNLTHCKSA-N
Molecular Weight 490.652 g/mol
SMILES [C@@]12(C([C@@]([H])(CC2)C[C@@]1(OCOC)[H])(C)C)CS(O[C@]1(C[C@]2(C[C@](C[C@]2(C1)[H])(OCOCCOC)[H])[H])[H])(=O)=O
SPLASH splash10-052p-0001900000-f39780d9a8d742d2ba2e
Source of Spectrum KC-1990-1666-4
Synonyms (3aR,6aS)-5-[(2-methoxyethoxy)methoxy]octahydro-2-pentalenyl[(1R,2S,4S)-2-(methoxymethoxy)-7,7-dimethylbicyclo[2.2.1]hept-1-yl]methanesulfonate 3.alpha.-(2-methoxyethoxy)methoxy-7.alpha.-[(1R,2S,4S)-2-methoxy-methoxyborane-10-sulphonyloxy]-1.beta.,5.beta.-bicyclo[3.3.0]octane
Wiley ID 1397201