| SpectraBase Compound ID | 3QuKFrZv9iq |
|---|---|
| InChI | InChI=1S/C12H16O3/c13-11-7-3-9-5-8(11)6-10(4-7)12(9)14-1-2-15-12/h7-10H,1-6H2/t7-,8+,9-,10- |
| InChIKey | ZIRUECKHCCXQIT-CHIWXEEVSA-N |
| Mol Weight | 208.26 g/mol |
| Molecular Formula | C12H16O3 |
| Exact Mass | 208.109944 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | ERpRQjgKdCJ |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C12H16O3 |
| InChI | InChI=1S/C12H16O3/c13-11-7-3-9-5-8(11)6-10(4-7)12(9)14-1-2-15-12/h7-10H,1-6H2/t7-,8+,9-,10- |
| InChIKey | ZIRUECKHCCXQIT-CHIWXEEVSA-N |
| Molecular Weight | 208.1095 |
| SMILES | [C@]12(C[C@@]3(C[C@](C[C@@](C3=O)(C1)[H])(C21OCCO1)[H])[H])[H] |
| SPLASH | splash10-052b-9410000000-dfecd282e097bfbd5b0f |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |