| SpectraBase Compound ID | Eqx2X1xfwMC |
|---|---|
| InChI | InChI=1S/C22H30O3/c1-14-7-8-19-21(2,3)9-6-10-22(19,4)17(14)12-15-11-16(23)13-18(25-5)20(15)24/h11-14,19H,6-10H2,1-5H3/b17-12+/t14-,19?,22+/m0/s1 |
| InChIKey | BKTCSIDMJZGVQO-HRIWSGOMSA-N |
| Mol Weight | 342.48 g/mol |
| Molecular Formula | C22H30O3 |
| Exact Mass | 342.219495 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LLClRO0GwYY |
|---|---|
| Name | Deoxyspongiaquinone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H30O3 |
| InChI | InChI=1S/C22H30O3/c1-14-7-8-19-21(2,3)9-6-10-22(19,4)17(14)12-15-11-16(23)13-18(25-5)20(15)24/h11-14,19H,6-10H2,1-5H3/b17-12+/t14-,19?,22+/m0/s1 |
| InChIKey | BKTCSIDMJZGVQO-HRIWSGOMSA-N |
| Molecular Weight | 342.479 g/mol |
| SMILES | [C@@]12(\C([C@](CCC2C(C)(C)CCC1)(C)[H])=C\C=1C(C(OC)=CC(C1)=O)=O)C |
| SPLASH | splash10-0f6x-0779000000-d8177a293c9a0ef74c93 |
| Source of Spectrum | JA-49-611-0 |
| Synonyms | 2-[(E)-((2S,8aS)-2,5,5,8a-tetramethyloctahydro-1(2H)-naphthalenylidene)methyl]-6-methoxybenzo-1,4-quinone 2-[(E)-[(2S,8aS)-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-2H-naphthalen-1-ylidene]methyl]-6-methoxycyclohexa-2,5-diene-1,4-dione 2-[(E)-[(2S,8aS)-2,5,5,8a-tetramethyldecalin-1-ylidene]methyl]-6-methoxy-1,4-benzoquinone 2-[(E)-[(2S,8aS)-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-2H-naphthalen-1-ylidene]methyl]-6-methoxy-cyclohexa-2,5-diene-1,4-dione |
| Wiley ID | 1336936 |