| SpectraBase Spectrum ID |
EFGZV4uCs6T |
| Name |
1(3H)-Isobenzofuranone, 3a,6,7,7a-tetrahydro-5,6-dimethyl-7-(phenylacetyl)-, (3a.alpha.,6.beta.,7.beta.,7a.alpha.)- |
| CAS Registry Number |
69854-71-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H20O3 |
| InChI |
InChI=1S/C18H20O3/c1-11-8-14-10-21-18(20)17(14)16(12(11)2)15(19)9-13-6-4-3-5-7-13/h3-8,12,14,16-17H,9-10H2,1-2H3/t12-,14-,16+,17+/m1/s1 |
| InChIKey |
QEKHQYLFTMLUIO-IRWJRLHMSA-N |
| Molecular Weight |
284.355 g/mol |
| SMILES |
[C@@]1(C(Cc2ccccc2)=O)([C@@]2([C@](COC2=O)([H])C=C([C@]1(C)[H])C)[H])[H] |
| SPLASH |
splash10-00kf-3910000000-267656d11787faaa5c3a |
| Source of Spectrum |
KC-1978-1506-0 |
| Synonyms |
(3aS,6S,7R,7aS)-5,6-dimethyl-7-(phenylacetyl)-3a,6,7,7a-tetrahydro-2-benzofuran-1(3H)-one
3,4-Dimethyl-5-phenylacetyl-7-oxo-8-oxabicyclo(4.3.0)non-2-ene |
| Wiley ID |
1288235 |
