| SpectraBase Spectrum ID |
C3ESLCWZVqW |
| Name |
8,14-epoxytotar-9(11)-ene-7,12,13-trione |
| Alternate Name(s) |
3a-isopropyl-7,7,10a-trimethyl-6a,7,8,9,10,10a-hexahydro-2H-phenanthro[1,10a-b]oxirene-2,3,5(3aH,6H)-trione |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H26O4 |
| InChI |
InChI=1S/C20H26O4/c1-11(2)19-16(23)12(21)9-14-18(5)8-6-7-17(3,4)13(18)10-15(22)20(14,19)24-19/h9,11,13H,6-8,10H2,1-5H3 |
| InChIKey |
DNUDHEXLJCTSPS-UHFFFAOYSA-N |
| Molecular Weight |
330.424 g/mol |
| SMILES |
C123C(C(C(=O)C=C3C3(C(C(CCC3)(C)C)CC2=O)C)=O)(C(C)C)O1 |
| SPLASH |
splash10-03di-0091000000-b3ab4482b3713dd36899 |
| Source of Spectrum |
B-46-1825-0 |
| Wiley ID |
1328089 |
