SpectraBase Compound ID | JCZuXFPaFiu |
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InChI | InChI=1S/C21H32O6/c1-7-12(2)18(22)25-16-8-13(3)20(5)11-17-14(4)19(27-23)26-21(17,24-6)10-15(20)9-16/h7,13,15-16,19,23H,8-11H2,1-6H3/b12-7-/t13-,15+,16+,19?,20+,21?/m0/s1 |
InChIKey | QDLVZGKRRJLNQJ-UPXOMNCHSA-N |
Mol Weight | 380.5 g/mol |
Molecular Formula | C21H32O6 |
Exact Mass | 380.219889 g/mol |
SpectraBase Spectrum ID | JhYgOTqgzvr |
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Name | 2.beta.-Angeloyloxy-10.beta.-H-8-methoxy-12-hydroperoxy-dihydro-furanoeremophilane |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C21H32O6 |
InChI | InChI=1S/C21H32O6/c1-7-12(2)18(22)25-16-8-13(3)20(5)11-17-14(4)19(27-23)26-21(17,24-6)10-15(20)9-16/h7,13,15-16,19,23H,8-11H2,1-6H3/b12-7-/t13-,15+,16+,19?,20+,21?/m0/s1 |
InChIKey | QDLVZGKRRJLNQJ-UPXOMNCHSA-N |
Instrument Name | VG-ZAB-HS |
Ionization Type | EI |
Literature Reference DOI | 10.3998/ark.5550190.0007.212 |
Molecular Weight | 380.481 g/mol |
SMILES | OOC1OC2(C(C[C@@]3([C@](C[C@@](OC(=O)\C(=C/C)C)(C[C@@]3(C2)[H])[H])(C)[H])C)=C1C)OC |
SPLASH | splash10-001i-9011000000-b66cc7b5bb3590e18292 |
Source of Spectrum | ARK-2006-114-7 |
Wiley ID | 1871241 |