| SpectraBase Compound ID | 3BDJwMwgObQ |
|---|---|
| InChI | InChI=1S/C15H22O2/c1-9-11-4-5-15(11,3)12-7-14(2,8-16)6-10(12)13(9)17/h10,12,16H,4-8H2,1-3H3/t10?,12?,14-,15-/m1/s1 |
| InChIKey | HPOGLDHHCCWZQO-CKCNXQLGSA-N |
| Mol Weight | 234.34 g/mol |
| Molecular Formula | C15H22O2 |
| Exact Mass | 234.16198 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | G3tI2wz0qnB |
|---|---|
| Name | Isoplorantinone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H22O2 |
| InChI | InChI=1S/C15H22O2/c1-9-11-4-5-15(11,3)12-7-14(2,8-16)6-10(12)13(9)17/h10,12,16H,4-8H2,1-3H3/t10?,12?,14-,15-/m1/s1 |
| InChIKey | HPOGLDHHCCWZQO-CKCNXQLGSA-N |
| Molecular Weight | 234.339 g/mol |
| SMILES | OC[C@]1(CC2[C@]3(C(=C(C)C(C2C1)=O)CC3)C)C |
| SPLASH | splash10-0a4i-0960000000-0bb2e8b63fc181f556d7 |
| Source of Spectrum | H-86-2432-5 |
| Wiley ID | 1525528 |