| SpectraBase Spectrum ID |
IWfv3txhfjn |
| Name |
(1S,2R,6R)-1-Hydroxy-3-(3-m-methoxyphenylpropyl)-6,8,8-trimethyl-2-oxabicyclo[4.3.0]nonan-7-one |
| Alternate Name(s) |
(4aS,7aS)-7a-hydroxy-2-[3-(3-methoxyphenyl)propyl]-4a,6,6-trimethylhexahydrocyclopenta[b]pyran-5(2H)-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H30O4 |
| InChI |
InChI=1S/C21H30O4/c1-19(2)14-21(23)20(3,18(19)22)12-11-16(25-21)9-5-7-15-8-6-10-17(13-15)24-4/h6,8,10,13,16,23H,5,7,9,11-12,14H2,1-4H3/t16?,20-,21+/m1/s1 |
| InChIKey |
GVVVBZQFHZSCJC-XHEPWMPHSA-N |
| Molecular Weight |
346.467 g/mol |
| SMILES |
O[C@]12[C@@](C(=O)C(C2)(C)C)(CCC(O1)CCCc1cc(OC)ccc1)C |
| SPLASH |
splash10-001i-0901000000-888ad38408cbe10f9436 |
| Source of Spectrum |
QC-8-3056-6 |
| Wiley ID |
870239 |
![(1S,2R,6R)-1-Hydroxy-3-(3-m-methoxyphenylpropyl)-6,8,8-trimethyl-2-oxabicyclo[4.3.0]nonan-7-one](/api/spectrum/IWfv3txhfjn/structure.png?h=300&w=458 "(1S,2R,6R)-1-Hydroxy-3-(3-m-methoxyphenylpropyl)-6,8,8-trimethyl-2-oxabicyclo[4.3.0]nonan-7-one")
