SpectraBase Spectrum ID |
IjfXj8Sh2ph |
Name |
Ethanone, 2-[1-[[3-(hydroxymethyl)bicyclo[2.2.1]hept-5-en-2-yl]methoxy]-5-methyl-2-(1-methylethyl)cyclohexyl]-1-phenyl-, [1R-[1.alpha.,2.beta.(1R*,2S*,5R*),3.beta.,4.alpha.]]- |
CAS Registry Number |
119972-94-0 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C27H38O3 |
InChI |
InChI=1S/C27H38O3/c1-18(2)25-12-9-19(3)14-27(25,15-26(29)20-7-5-4-6-8-20)30-17-24-22-11-10-21(13-22)23(24)16-28/h4-8,10-11,18-19,21-25,28H,9,12-17H2,1-3H3/t19-,21+,22+,23+,24?,25+,27-/m1/s1 |
InChIKey |
BIZHCGQUNATQIM-GLWBVENTSA-N |
Molecular Weight |
410.598 g/mol |
SMILES |
OC[C@]1([C@]2(C=C[C@](C1CO[C@]1(CC(=O)c3ccccc3)[C@@](CC[C@](C1)(C)[H])(C(C)C)[H])(C2)[H])[H])[H] |
SPLASH |
splash10-0a4i-0920000000-3cfead7b2cce61a93745 |
Source of Spectrum |
J-54-2605-21 |
Synonyms |
2-((1R,2S,5R)-1-{[(3S,4R)-3-(hydroxymethyl)bicyclo[2.2.1]hept-5-en-2-yl]methoxy}-2-isopropyl-5-methylcyclohexyl)-1-phenylethanone |
Wiley ID |
1373831 |