| SpectraBase Compound ID | 5Qzj0vtZ7Kg |
|---|---|
| InChI | InChI=1S/C13H12O2/c1-3-12(14)10-7-5-6-8-11(9-10)13(15)4-2/h1-2,5-8,12-15H,9H2 |
| InChIKey | INBCFBCNXAMHJJ-UHFFFAOYSA-N |
| Mol Weight | 200.24 g/mol |
| Molecular Formula | C13H12O2 |
| Exact Mass | 200.08373 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CTCjsge2jhA |
|---|---|
| Name | 1,6-BIS-(1-HYDROXYPROP-2-YNYL)-CYCLOHEPTA-1,3,5-TRIENE;RS-ISOMER |
| Compound Number | 15A |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C13H12O2/c1-3-12(14)10-7-5-6-8-11(9-10)13(15)4-2/h1-2,5-8,12-15H,9H2 |
| InChIKey | INBCFBCNXAMHJJ-UHFFFAOYSA-N |
| Literature Reference | J.CHEM.SOC.PERKIN-1,1453(1994) H.HIGUCHI,K.ASANO,J.OJIMA,K.YAMAMOTO,T.YOSHIDA,T.ADACHI,G.YAMAMOTO |
| Solvent | Chloroform-d |