SpectraBase Spectrum ID |
Jilcl6qpPGg |
Name |
Ethyl E-(6S,7S,8R)-6,7-cyclohexylidenedioxy-8,9-isopropylidenedioxy-4-nonenoate |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
354.204238680 u |
Formula |
C19H30O6 |
InChI |
InChI=1S/C19H30O6/c1-18(2)22-13-15(23-18)17-14(9-5-6-10-16(20)21-3)24-19(25-17)11-7-4-8-12-19/h5,9,14-15,17H,4,6-8,10-13H2,1-3H3/b9-5+/t14-,15+,17-/m0/s1 |
InChIKey |
OGNBPWZBPDQAJV-OQACOVGMSA-N |
Molecular Weight |
354.443 g/mol |
SMILES |
[C@@]1([C@@]2(OC(C)(C)OC2)[H])(OC2(CCCCC2)O[C@]1(\C=C\CCC(=O)OC)[H])[H] |