| SpectraBase Spectrum ID |
JMRPwFrFaSg |
| Name |
(1S,2S,4R,8S)-2-[bis(methylthio)methyl]-2,4-dimethoxy-3-oxo-8-bicyclo[2.2.2]oct-5-enecarboxylic acid tert-butyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H28O5S2 |
| InChI |
InChI=1S/C18H28O5S2/c1-16(2,3)23-13(19)12-10-11-8-9-17(12,21-4)14(20)18(11,22-5)15(24-6)25-7/h8-9,11-12,15H,10H2,1-7H3/t11-,12-,17-,18+/m1/s1 |
| InChIKey |
JOWYNBCMEPVZFS-RHMWETHNSA-N |
| Molecular Weight |
388.537 g/mol |
| SMILES |
C1([C@@]2([C@](C(OC(C)(C)C)=O)([H])C[C@]([C@]1(C(SC)SC)OC)(C=C2)[H])OC)=O |
| SPLASH |
splash10-056r-0093000000-0df3cb50881c21b1cf17 |
| Source of Spectrum |
KC-0-569-21 |
| Synonyms |
(1S,2S,4R,8S)-2-[bis(methylthio)methyl]-3-keto-2,4-dimethoxy-bicyclo[2.2.2]oct-5-ene-8-carboxylic acid tert-butyl ester
tert-Butyl (1S,2S,4R,8S)-2-[bis(methylsulfanyl)methyl]-2,4-dimethoxy-3-oxidanylidene-bicyclo[2.2.2]oct-5-ene-8-carboxylate
tert-Butyl (1S,2S,4R,8S)-2-[bis(methylsulfanyl)methyl]-2,4-dimethoxy-3-oxo-bicyclo[2.2.2]oct-5-ene-8-carboxylate |
| Wiley ID |
787490 |
![(1S,2S,4R,8S)-2-[bis(methylthio)methyl]-2,4-dimethoxy-3-oxo-8-bicyclo[2.2.2]oct-5-enecarboxylic acid tert-butyl ester](/api/spectrum/JMRPwFrFaSg/structure.png?h=300&w=458 "(1S,2S,4R,8S)-2-[bis(methylthio)methyl]-2,4-dimethoxy-3-oxo-8-bicyclo[2.2.2]oct-5-enecarboxylic acid tert-butyl ester")
