SpectraBase Spectrum ID |
IBogWtsCxVh |
Name |
(3r,5r,7r)-1-((E)-4-(4-methoxyphenyl)buta-1,3-dien-2-yl)adamantane |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H26O |
InChI |
InChI=1S/C21H26O/c1-15(3-4-16-5-7-20(22-2)8-6-16)21-12-17-9-18(13-21)11-19(10-17)14-21/h3-8,17-19H,1,9-14H2,2H3/b4-3+/t17-,18+,19-,21- |
InChIKey |
FBAFBOWVNLQARE-DCXRJTRLSA-N |
Literature Reference DOI |
10.1039/c4cc03651d |
Molecular Weight |
294.438 g/mol |
SMILES |
C1[C@]2(CC3(C[C@@]1(C[C@@](C2)(C3)[H])[H])C(\C=C\c1ccc(cc1)OC)=C)[H] |
SPLASH |
splash10-0a4u-2910000000-516f4da364d0aa8d8974 |
Source of Spectrum |
KD-50-8050/SMS5-3c |
Wiley ID |
1754733 |