| SpectraBase Compound ID | 3nJGaacMUhO |
|---|---|
| InChI | InChI=1S/C20H26O4/c1-13-3-6-19-12-24-18(22)20(13,7-4-15-5-8-23-11-15)17(19)10-16(21)9-14(19)2/h5,8-9,11,13,16-17,21H,3-4,6-7,10,12H2,1-2H3/t13-,16+,17+,19-,20-/m1/s1 |
| InChIKey | KSGJYTVKJMODGD-VMCMCTHWSA-N |
| Mol Weight | 330.42 g/mol |
| Molecular Formula | C20H26O4 |
| Exact Mass | 330.183109 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9bgASpdR1pc |
|---|---|
| Name | 2-Hydroxy-5,8-(carbonyloxymethano)cajucarin A |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H26O4 |
| InChI | InChI=1S/C20H26O4/c1-13-3-6-19-12-24-18(22)20(13,7-4-15-5-8-23-11-15)17(19)10-16(21)9-14(19)2/h5,8-9,11,13,16-17,21H,3-4,6-7,10,12H2,1-2H3/t13-,16+,17+,19-,20-/m1/s1 |
| InChIKey | KSGJYTVKJMODGD-VMCMCTHWSA-N |
| Molecular Weight | 330.424 g/mol |
| SMILES | O[C@]1(C=C([C@]23[C@@]([C@@](CCc4cocc4)([C@@](CC3)(C)[H])C(OC2)=O)(C1)[H])C)[H] |
| SPLASH | splash10-0a4i-0951000000-91efd0ddce00ee2c6956 |
| Source of Spectrum | E1-38-704-4 |
| Wiley ID | 1518199 |