| SpectraBase Spectrum ID |
EJh60sxgoHB |
| Name |
[(1R,2S,6S,7R,10S,12S,13S)-13-hydroxy-2,6,13-trimethyltetracyclo[10.3.1.0(1,10).0(2,7)]hexadecan-6-yl]methyl acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H36O3 |
| InChI |
InChI=1S/C22H36O3/c1-15(23)25-14-19(2)8-5-9-20(3)18(19)7-6-16-12-17-13-22(16,20)11-10-21(17,4)24/h16-18,24H,5-14H2,1-4H3/t16-,17-,18-,19+,20-,21-,22+/m0/s1 |
| InChIKey |
LKNVAANUPKAKGZ-XZNYGTFNSA-N |
| Instrument Name |
Shimadzu GCMS-QP5000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.jnatprod.5b00834 |
| Molecular Weight |
348.527 g/mol |
| Reported Formula |
C22H36O3 |
| SMILES |
O[C@]1(CC[C@@]23[C@]4(CCC[C@@]([C@@]4(CC[C@]3(C[C@]1(C2)[H])[H])[H])(COC(=O)C)C)C)C |
| SPLASH |
splash10-053r-4944000000-62336f7c8558e3d3a7ac |
| Source of Spectrum |
G4-79-1158-(+)-1 |
| Wiley ID |
1849284 |
