| SpectraBase Spectrum ID |
1ClZmfhyhaD |
| Name |
(3S*,3aR*,4S*,7aS*)-7-Methylene-3-(3,4,5-trimethoxybenzyl)octahydro-1H-inden-4-yl acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H30O5 |
| InChI |
InChI=1S/C22H30O5/c1-13-6-9-18(27-14(2)23)21-16(7-8-17(13)21)10-15-11-19(24-3)22(26-5)20(12-15)25-4/h11-12,16-18,21H,1,6-10H2,2-5H3/t16-,17+,18-,21+/m0/s1 |
| InChIKey |
IENBKEWPXFGKHU-TWFHAPMSSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/ml300283f |
| Molecular Weight |
374.477 g/mol |
| Reported Formula |
C22H30O5 |
| SMILES |
[C@@]1(CC[C@]2([C@@]1([C@](CCC2=C)(OC(C)=O)[H])[H])[H])(Cc1cc(c(c(c1)OC)OC)OC)[H] |
| SPLASH |
splash10-0089-1915000000-fa450353dbfa6840c110 |
| Source of Spectrum |
MCS-3-SM10-8e |
| Wiley ID |
1864126 |
