| SpectraBase Compound ID | 88bzMqzNRWe |
|---|---|
| InChI | InChI=1S/C37H41F5/c1-25(15-10-17-27(3)20-22-30-32(38)34(40)36(42)35(41)33(30)39)13-8-9-14-26(2)16-11-18-28(4)21-23-31-29(5)19-12-24-37(31,6)7/h8-11,13-18,20-23H,12,19,24H2,1-7H3/b9-8+,15-10+,16-11+,22-20+,23-21+,25-13+,26-14+,27-17+,28-18+ |
| InChIKey | QYTIRSIQJQNIOQ-VWVVNQSJSA-N |
| Mol Weight | 580.7 g/mol |
| Molecular Formula | C37H41F5 |
| Exact Mass | 580.312842 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6AD7Puacuqx |
|---|---|
| Name | 7'-PENTAFLUOROPHENYL-7'-APO-BETA-CAROTENE |
| Compound Number | 1 A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H41F5 |
| InChI | InChI=1S/C37H41F5/c1-25(15-10-17-27(3)20-22-30-32(38)34(40)36(42)35(41)33(30)39)13-8-9-14-26(2)16-11-18-28(4)21-23-31-29(5)19-12-24-37(31,6)7/h8-11,13-18,20-23H,12,19,24H2,1-7H3/b9-8+,15-10+,16-11+,22-20+,23-21+,25-13+,26-14+,27-17+,28-18+ |
| InChIKey | QYTIRSIQJQNIOQ-VWVVNQSJSA-N |
| Literature Reference Author | E.S.HAND,K.A.BELMORE,L.D.KISPERT |
| Literature Reference Citation | MAGN.RES.CHEM.,31,516(1993) |
| Literature Reference DOI | 10.1002/mrc.1260310519 |
| Molecular Weight | 580.725 g/mol |
| Solvent | CDCl3(0.04M) |
| Source File Reference | UWMR308 |