SpectraBase Spectrum ID |
JdTQVneYu2z |
Name |
(1S,2S,4R,8S)-2,4-dimethoxy-2-[(methylthio)methyl]-3-oxo-8-bicyclo[2.2.2]oct-5-enecarboxylic acid ethyl ester |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C15H22O5S |
InChI |
InChI=1S/C15H22O5S/c1-5-20-12(16)11-8-10-6-7-14(11,18-2)13(17)15(10,19-3)9-21-4/h6-7,10-11H,5,8-9H2,1-4H3/t10-,11-,14-,15+/m1/s1 |
InChIKey |
XDRATRYKIQMSEP-FKGLVLAHSA-N |
Molecular Weight |
314.396 g/mol |
SMILES |
[C@]12(C([C@](OC)(CSC)[C@](C=C2)(C[C@@]1(C(=O)OCC)[H])[H])=O)OC |
SPLASH |
splash10-000i-0090000000-498f18789c181529de4f |
Source of Spectrum |
KC-0-567-8 |
Synonyms |
(1S,2S,4R,8S)-3-keto-2,4-dimethoxy-2-[(methylthio)methyl]bicyclo[2.2.2]oct-5-ene-8-carboxylic acid ethyl ester
Ethyl (1S,2S,4R,8S)-2,4-dimethoxy-2-(methylsulfanylmethyl)-3-oxidanylidene-bicyclo[2.2.2]oct-5-ene-8-carboxylate
Ethyl (1S,2S,4R,8S)-2,4-dimethoxy-2-(methylsulfanylmethyl)-3-oxo-bicyclo[2.2.2]oct-5-ene-8-carboxylate |
Wiley ID |
787511 |