| SpectraBase Compound ID | 19C4BByksNo |
|---|---|
| InChI | InChI=1S/C12H8O4/c13-8-11-10(16-11)6-2-1-4-9-5-3-7-12(14)15-9/h3,5,7,10-11,13H,8H2/t10?,11-/m0/s1 |
| InChIKey | MQOZGGCYMXWCPG-DTIOYNMSSA-N |
| Mol Weight | 216.19 g/mol |
| Molecular Formula | C12H8O4 |
| Exact Mass | 216.042259 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9BT21uXbS4r |
|---|---|
| Name | (-)-Nitidon |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H8O4 |
| InChI | InChI=1S/C12H8O4/c13-8-11-10(16-11)6-2-1-4-9-5-3-7-12(14)15-9/h3,5,7,10-11,13H,8H2/t10?,11-/m0/s1 |
| InChIKey | MQOZGGCYMXWCPG-DTIOYNMSSA-N |
| Molecular Weight | 216.192 g/mol |
| SMILES | OC[C@@]1(OC1C#CC#CC=1OC(=O)C=CC1)[H] |
| SPLASH | splash10-0fb9-0900000000-12ab19f8123b1c4acf14 |
| Source of Spectrum | K1-2004-2618-1 |
| Wiley ID | 1561072 |