| SpectraBase Compound ID | 12O4mehCPON |
|---|---|
| InChI | InChI=1S/C18H24O2/c1-9-5-13-14(6-10(9)2)18(20)16-8-12(4)11(3)7-15(16)17(13)19/h13-16H,5-8H2,1-4H3/t13-,14-,15+,16+ |
| InChIKey | XGVLKZBDQXJEBB-RUPPMWDTSA-N |
| Mol Weight | 272.39 g/mol |
| Molecular Formula | C18H24O2 |
| Exact Mass | 272.17763 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B19ai1B6juw |
|---|---|
| Name | 9,10-Anthracenedione, 1,4,4a,5,8,8a,9a,10a-octahydro-2,3,6,7-tetramethyl-, (4a.alpha.,8a.beta.,9a.beta.,10a.alpha.)- |
| CAS Registry Number | 125591-41-5 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H24O2 |
| InChI | InChI=1S/C18H24O2/c1-9-5-13-14(6-10(9)2)18(20)16-8-12(4)11(3)7-15(16)17(13)19/h13-16H,5-8H2,1-4H3/t13-,14-,15+,16+ |
| InChIKey | XGVLKZBDQXJEBB-RUPPMWDTSA-N |
| Molecular Weight | 272.388 g/mol |
| SMILES | [C@@]12([C@](C(=O)[C@@]3([C@@](C2=O)(CC(=C(C)C3)C)[H])[H])(CC(=C(C1)C)C)[H])[H] |
| SPLASH | splash10-0006-9310000000-035a7c59709f346e21f2 |
| Source of Spectrum | B-42-522-5 |
| Synonyms | (4aR,8aS,9aR,10aS)-2,3,6,7-tetramethyl-1,4,4a,5,8,8a,9a,10a-octahydro-9,10-anthracenedione (4aR,8aS,9aR,10aS)-2,3,6,7-tetramethyl-1,4,4a,5,8,8a,9a,10a-octahydroanthracene-9,10-dione (4aR,8aS,9aR,10aS)-2,3,6,7-tetramethyl-1,4,4a,5,8,8a,9a,10a-octahydroanthracene-9,10-quinone 2,3,6,7-Tetramethyl-1,4,4.alpha.,5,8,8a.beta.,9a.beta.,10a.alpha.-octahydroanthracene-9,10-dione (4aS,8aR,9aS,10aR)-2,3,6,7-tetramethyl-1,4,4a,5,8,8a,9a,10a-octahydroanthracene-9,10-dione |
| Wiley ID | 1276590 |