SpectraBase Spectrum ID |
EkPXhIQTG6x |
Name |
Ethanone, 2-[1-[(8-hydroxy-4-cycloocten-1-yl)oxy]-5-methyl-2-(1-methylethyl)cyclohexyl]-1-phenyl-, [1R-[1.alpha.(1R*,8S*),2.alpha.,5.beta.]]- |
CAS Registry Number |
119972-81-5 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C26H38O3 |
InChI |
InChI=1S/C26H38O3/c1-19(2)22-16-15-20(3)17-26(22,18-24(28)21-11-7-6-8-12-21)29-25-14-10-5-4-9-13-23(25)27/h4-8,11-12,19-20,22-23,25,27H,9-10,13-18H2,1-3H3/b5-4-/t20-,22+,23+,25?,26-/m1/s1 |
InChIKey |
ABKBKSHXVULXML-YVEYGJQJSA-N |
Molecular Weight |
398.587 g/mol |
SMILES |
O[C@@]1(C(O[C@]2(CC(=O)c3ccccc3)[C@@](CC[C@](C2)(C)[H])(C(C)C)[H])CC\C=C/CC1)[H] |
SPLASH |
splash10-0a4i-0920000000-0cb8c3fe00e5c58ef9a8 |
Source of Spectrum |
J-54-2603-9 |
Synonyms |
2-((1R,2S,5R)-1-{[(8S)-8-hydroxy-4-cycloocten-1-yl]oxy}-2-isopropyl-5-methylcyclohexyl)-1-phenylethanone |
Wiley ID |
1368658 |