SpectraBase Spectrum ID |
6LSdqamS6jL |
Name |
trans-1-[6'-Bromo-4',4'-bis(ethoxycarbonyl)-6'-heptene-1'-ynyl]-1-hydroxy-2-(2"-propenyl)cyclohexane |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H31BrO5 |
InChI |
InChI=1S/C22H31BrO5/c1-5-11-18-12-8-9-14-22(18,26)15-10-13-21(16-17(4)23,19(24)27-6-2)20(25)28-7-3/h5,18,26H,1,4,6-9,11-14,16H2,2-3H3/t18-,22+/m0/s1 |
InChIKey |
QYVTYFRTJYXKRK-PGRDOPGGSA-N |
Molecular Weight |
455.389 g/mol |
SMILES |
O[C@]1(C#CCC(C(=O)OCC)(C(=O)OCC)CC(=C)Br)[C@@](CC=C)(CCCC1)[H] |
SPLASH |
splash10-0537-6349200000-419ab2e296edc41fff42 |
Source of Spectrum |
F-52-11557-7 |
Synonyms |
Diethyl 2-{3-[(1S,2R)-2-allyl-1-hydroxycyclohexyl]-2-propynyl}-2-(2-bromo-2-propenyl)malonate |
Wiley ID |
798529 |