| SpectraBase Spectrum ID |
4RP4Fapre5m |
| Name |
[(1R*,2S*,3R*,5R*)-5-Acetoxy-2-(acetylamino)-2,6,6-trimethyl-3-phenylcyclohexyl]methyl acetate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H31NO5 |
| InChI |
InChI=1S/C22H31NO5/c1-14(24)23-22(6)18(17-10-8-7-9-11-17)12-20(28-16(3)26)21(4,5)19(22)13-27-15(2)25/h7-11,18-20H,12-13H2,1-6H3,(H,23,24)/t18-,19-,20-,22+/m1/s1 |
| InChIKey |
FFEPJZPWQPCMPD-VMBXEPDQSA-N |
| Molecular Weight |
389.492 g/mol |
| SMILES |
N([C@@]1([C@@](C(C)(C)[C@@](C[C@@]1(c1ccccc1)[H])(OC(=O)C)[H])(COC(=O)C)[H])C)C(=O)C |
| SPLASH |
splash10-0006-9000000000-d5053cdea9f894bf9ba1 |
| Source of Spectrum |
J-62-4623-8 |
| Synonyms |
(1R,3R,4S,5R)-4-(acetylamino)-3-[(acetyloxy)methyl]-2,2,4-trimethyl-5-phenylcyclohexyl acetate |
| Wiley ID |
1364376 |
![[(1R*,2S*,3R*,5R*)-5-Acetoxy-2-(acetylamino)-2,6,6-trimethyl-3-phenylcyclohexyl]methyl acetate](/api/spectrum/4RP4Fapre5m/structure.png?h=300&w=458 "[(1R*,2S*,3R*,5R*)-5-Acetoxy-2-(acetylamino)-2,6,6-trimethyl-3-phenylcyclohexyl]methyl acetate")
