SpectraBase Spectrum ID |
87USJc0AJo6 |
Name |
Methyl (2SR)-2-(2-Iodobenzyl)-3-[(1SR)-2-oxocyclohexyl]propanoate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H21IO3 |
InChI |
InChI=1S/C17H21IO3/c1-21-17(20)14(10-12-6-2-4-8-15(12)18)11-13-7-3-5-9-16(13)19/h2,4,6,8,13-14H,3,5,7,9-11H2,1H3/t13-,14+/m0/s1 |
InChIKey |
PWYUYVLYFAEANE-UONOGXRCSA-N |
Literature Reference DOI |
10.1021/ol901183h |
Molecular Weight |
400.256 g/mol |
SMILES |
c1cc(C[C@@](C(=O)OC)(C[C@]2(C(CCCC2)=O)[H])[H])c(I)cc1 |
SPLASH |
splash10-00kf-2592100000-7a4dc6abee7a86b903c6 |
Source of Spectrum |
A1-11-3334/SM5-8a |
Synonyms |
(S)-methyl 2-(2-iodobenzyl)-3-((S)-2-oxocyclohexyl)propanoate |
Wiley ID |
1757025 |