| SpectraBase Spectrum ID |
1u2uvvM99WQ |
| Name |
(1R,6S,7S)-(3-methyl)-7-benzyloxymethyl-8-oxabicyclo[4.3.0]non-3-en-9-one |
| Alternate Name(s) |
(3S,3aS,7aR)-3-[(benzyloxy)methyl]-6-methyl-3a,4,7,7a-tetrahydro-2-benzofuran-1(3H)-one |
| CAS Registry Number |
111533-97-2 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H20O3 |
| InChI |
InChI=1S/C17H20O3/c1-12-7-8-14-15(9-12)17(18)20-16(14)11-19-10-13-5-3-2-4-6-13/h2-7,14-16H,8-11H2,1H3/t14-,15+,16+/m0/s1 |
| InChIKey |
ARPPTULJYCCRRJ-ARFHVFGLSA-N |
| Molecular Weight |
272.344 g/mol |
| SMILES |
C1(O[C@](COCc2ccccc2)([C@@]2([C@]1(CC(=CC2)C)[H])[H])[H])=O |
| SPLASH |
splash10-0006-9010000000-e266ca11e5b69504611e |
| Source of Spectrum |
F-44-1717-20 |
| Wiley ID |
1276442 |
![(1R,6S,7S)-(3-methyl)-7-benzyloxymethyl-8-oxabicyclo[4.3.0]non-3-en-9-one](/api/spectrum/1u2uvvM99WQ/structure.png?h=300&w=458 "(1R,6S,7S)-(3-methyl)-7-benzyloxymethyl-8-oxabicyclo[4.3.0]non-3-en-9-one")
