| SpectraBase Compound ID | A1hifWdoKQ6 |
|---|---|
| InChI | InChI=1S/C17H12O2/c1-2-6-14(7-3-1)8-4-5-9-15-10-11-16-17(12-15)19-13-18-16/h1-3,5-7,9-12H,13H2/b9-5+ |
| InChIKey | HMJQKNPBSQIVLY-WEVVVXLNSA-N |
| Mol Weight | 248.28 g/mol |
| Molecular Formula | C17H12O2 |
| Exact Mass | 248.08373 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I2bEgha9AnQ |
|---|---|
| Name | (E)-1-(3,4-METHYLENEDIOXYPHENYL)-4-PHENYLBUT-1-EN-3-YNE |
| Compound Number | 12R |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C17H12O2/c1-2-6-14(7-3-1)8-4-5-9-15-10-11-16-17(12-15)19-13-18-16/h1-3,5-7,9-12H,13H2/b9-5+ |
| InChIKey | HMJQKNPBSQIVLY-WEVVVXLNSA-N |
| Literature Reference | R.A.AITKEN,C.BOETERS,J.J.MORRISON J.CHEM.SOC.PERKIN-1,2473(1994) |
| Solvent | Chloroform-d |