| SpectraBase Spectrum ID |
CHJa5ObTlsD |
| Name |
{(2R,3S,3aS)-2-(3',4'-Dimethoxyphenyl)-3,3a-dihydro-5-methoxy-3-methyl-3a-(2'-propenyl)-2-benzofuran-6(2H)-one |
| Alternate Name(s) |
(2R,3S,3aS)-3a-allyl-2-(3,4-dimethoxyphenyl)-5-methoxy-3-methyl-3,3a-dihydro-1-benzofuran-6(2H)-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H24O5 |
| InChI |
InChI=1S/C21H24O5/c1-6-9-21-12-18(25-5)15(22)11-19(21)26-20(13(21)2)14-7-8-16(23-3)17(10-14)24-4/h6-8,10-13,20H,1,9H2,2-5H3/t13-,20-,21-/m1/s1 |
| InChIKey |
CMTIOXAVRNUFAG-OBVPDXSSSA-N |
| Molecular Weight |
356.418 g/mol |
| SMILES |
C1=2[C@](C=C(C(C2)=O)OC)([C@](C)([C@@](O1)(c1cc(OC)c(cc1)OC)[H])[H])CC=C |
| SPLASH |
splash10-0929-2905000000-eb65c5358e3ce3ccf217 |
| Source of Spectrum |
SB-49-146-1 |
| Wiley ID |
1345931 |
