| SpectraBase Compound ID | 5IJW6Nx769b |
|---|---|
| InChI | InChI=1S/C12H16O3/c1-12-5-8(13)9-6(3-4-7(9)12)10(12)11(14)15-2/h6-7,9-10H,3-5H2,1-2H3/t6-,7+,9-,10-,12-/m1/s1 |
| InChIKey | LSNQXLAZHBQDNN-WBAPNQQASA-N |
| Mol Weight | 208.26 g/mol |
| Molecular Formula | C12H16O3 |
| Exact Mass | 208.109944 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Jgvs04NpB90 |
|---|---|
| Name | 1,4-METHANOPENTALENE-7-CARBOXYLIC ACID, OCTAHYDRO-1-METHYL-3-OXO-METHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H16O3 |
| InChI | InChI=1S/C12H16O3/c1-12-5-8(13)9-6(3-4-7(9)12)10(12)11(14)15-2/h6-7,9-10H,3-5H2,1-2H3/t6-,7+,9-,10-,12-/m1/s1 |
| InChIKey | LSNQXLAZHBQDNN-WBAPNQQASA-N |
| Instrument Name | BRUKER WH-360 |
| NMR Standard | TMS |
| Solvent | CDCL3 |