SpectraBase Spectrum ID |
6KhixjghlMY |
Name |
Ethyl (4aS*,7R*,8S*,8aR*)-7-methyl-1-oxo-3,4,4a,7,8,8a-hexahydro-1H-isochromene-8-carboxylate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C13H18O4 |
InChI |
InChI=1S/C13H18O4/c1-3-16-12(14)10-8(2)4-5-9-6-7-17-13(15)11(9)10/h4-5,8-11H,3,6-7H2,1-2H3/t8-,9-,10+,11-/m1/s1 |
InChIKey |
VSOZQBCRTPEXHA-CHWFTXMASA-N |
Molecular Weight |
238.283 g/mol |
SMILES |
[C@]12(C(OCC[C@]1(C=C[C@]([C@@]2(C(=O)OCC)[H])(C)[H])[H])=O)[H] |
SPLASH |
splash10-052f-1900000000-fa9eafd01a68008de1b0 |
Source of Spectrum |
F-67-189-26c |
Wiley ID |
1685354 |