| SpectraBase Compound ID | 7JkvFbIRjz7 |
|---|---|
| InChI | InChI=1S/C12H18O3/c1-7-3-4-9(13)12-6-5-8(10(14)15-12)11(7,12)2/h7-9,13H,3-6H2,1-2H3/t7-,8+,9+,11-,12-/m0/s1 |
| InChIKey | INZNWRIFLOKNQB-MZQLCRGXSA-N |
| Mol Weight | 210.27 g/mol |
| Molecular Formula | C12H18O3 |
| Exact Mass | 210.125594 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2WdsIf6th9a |
|---|---|
| Name | Rivula-lactone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H18O3 |
| InChI | InChI=1S/C12H18O3/c1-7-3-4-9(13)12-6-5-8(10(14)15-12)11(7,12)2/h7-9,13H,3-6H2,1-2H3/t7-,8+,9+,11-,12-/m0/s1 |
| InChIKey | INZNWRIFLOKNQB-MZQLCRGXSA-N |
| Molecular Weight | 210.273 g/mol |
| SMILES | O[C@]1([C@@]23[C@]([C@](CC3)(C(O2)=O)[H])([C@@](C)(CC1)[H])C)[H] |
| SPLASH | splash10-00lr-9300000000-6a6cc61a956f72b17a8a |
| Source of Spectrum | G4-60-1285-6 |
| Wiley ID | 1607010 |