| SpectraBase Spectrum ID |
BXuxBPPHtcQ |
| Name |
(5aR,9aR)-2,2,3,3-tetramethyl-5a,6,7,9a-tetrahydro-1,4-benzodioxepin-5-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H20O3 |
| InChI |
InChI=1S/C13H20O3/c1-12(2)13(3,4)16-11(14)9-7-5-6-8-10(9)15-12/h6,8-10H,5,7H2,1-4H3/t9-,10-/m1/s1 |
| InChIKey |
IQAXXEAEJWEZBM-NXEZZACHSA-N |
| Molecular Weight |
224.300 g/mol |
| SMILES |
C1(OC(C(C)(C)O[C@]2([C@]1(CCC=C2)[H])[H])(C)C)=O |
| SPLASH |
splash10-003r-9000000000-8a6c0db52bed30f427f1 |
| Source of Spectrum |
KC-0-887-19 |
| Wiley ID |
824403 |
