| SpectraBase Spectrum ID |
3a7kUSWoXus |
| Name |
(3S,3aS,4S,5S,7aR)-4,5-Di(4-methoxybenzyl)oxy-3-methyl-3a,4,6,6,7,7a-hexahydrobenzo[b]furan-2(3H)-one |
| Alternate Name(s) |
(3S,3aR,4S,5S,7aR)-4,5-Di(4-methoxybenzyl)oxy-3-methyl-3a,4,6,6,7,7a-hexahydrobenzo[b]furan-2(3H)-one
(3S,3aS,4S,5S,7aR)-4,5-bis[(4-methoxybenzyl)oxy]-3-methylhexahydro-1-benzofuran-2(3H)-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H30O6 |
| InChI |
InChI=1S/C25H30O6/c1-16-23-21(31-25(16)26)12-13-22(29-14-17-4-8-19(27-2)9-5-17)24(23)30-15-18-6-10-20(28-3)11-7-18/h4-11,16,21-24H,12-15H2,1-3H3/t16-,21+,22-,23+,24+/m0/s1 |
| InChIKey |
PFMHVZQCSSXJIA-AEXWLAFLSA-N |
| Molecular Weight |
426.509 g/mol |
| SMILES |
[C@]12([C@](OC([C@]2(C)[H])=O)(CC[C@@]([C@]1(OCc1ccc(cc1)OC)[H])(OCc1ccc(cc1)OC)[H])[H])[H] |
| SPLASH |
splash10-0a4i-0009000000-39d2b6baa66daff398d2 |
| Source of Spectrum |
F-55-2215-23 |
| Wiley ID |
837002 |
![(3S,3aS,4S,5S,7aR)-4,5-Di(4-methoxybenzyl)oxy-3-methyl-3a,4,6,6,7,7a-hexahydrobenzo[b]furan-2(3H)-one](/api/spectrum/3a7kUSWoXus/structure.png?h=300&w=458 "(3S,3aS,4S,5S,7aR)-4,5-Di(4-methoxybenzyl)oxy-3-methyl-3a,4,6,6,7,7a-hexahydrobenzo[b]furan-2(3H)-one")
