SpectraBase Spectrum ID |
9FwVTFkKbg5 |
Name |
(1S,2S,8S,8as)-8-(3'-Hydroxypropyl)-7-methyl-1,2,3,7,8,8A-hexahydro-1-naphthyl (S)-2-methylbutanoate |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
306.219494823 u |
Formula |
C19H30O3 |
InChI |
InChI=1S/C19H30O3/c1-4-13(2)19(21)22-17-9-5-7-15-11-10-14(3)16(18(15)17)8-6-12-20/h7,10-11,13-14,16-18,20H,4-6,8-9,12H2,1-3H3/t13-,14-,16-,17-,18+/m0/s1 |
InChIKey |
OAKNLEUODLVQPI-YECZKDOJSA-N |
SMILES |
[C@@]12([C@@](OC(=O)[C@](CC)(C)[H])(CCC=C2C=C[C@@]([C@@]1(CCCO)[H])(C)[H])[H])[H] |