| SpectraBase Spectrum ID |
G1MsGuYio4x |
| Name |
(1R,6S,7R)-(3,7-dimethyl)-8-oxabicyclo[4.3.0]non-3-en-9-one |
| Alternate Name(s) |
(3R,3aS,7aR)-3,6-dimethyl-3a,4,7,7a-tetrahydro-2-benzofuran-1(3H)-one |
| CAS Registry Number |
111533-95-0 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H14O2 |
| InChI |
InChI=1S/C10H14O2/c1-6-3-4-8-7(2)12-10(11)9(8)5-6/h3,7-9H,4-5H2,1-2H3/t7-,8-,9-/m1/s1 |
| InChIKey |
ZTBDNOFTLDERTQ-IWSPIJDZSA-N |
| Molecular Weight |
166.220 g/mol |
| SMILES |
C1(O[C@](C)([C@@]2([C@]1(CC(=CC2)C)[H])[H])[H])=O |
| SPLASH |
splash10-0006-9200000000-e9a00c0ca6bf9bf000bb |
| Source of Spectrum |
F-44-1717-19 |
| Wiley ID |
1162661 |
![(1R,6S,7R)-(3,7-dimethyl)-8-oxabicyclo[4.3.0]non-3-en-9-one](/api/spectrum/G1MsGuYio4x/structure.png?h=300&w=458 "(1R,6S,7R)-(3,7-dimethyl)-8-oxabicyclo[4.3.0]non-3-en-9-one")
