| SpectraBase Compound ID | 9K7VwYifOVI |
|---|---|
| InChI | InChI=1S/C13H18O2/c1-2-3-7-12(10-13(14)15)11-8-5-4-6-9-11/h4-6,8-9,12H,2-3,7,10H2,1H3,(H,14,15)/t12-/m0/s1 |
| InChIKey | YEUNYNJOKMJRMC-LBPRGKRZSA-N |
| Mol Weight | 206.28 g/mol |
| Molecular Formula | C13H18O2 |
| Exact Mass | 206.13068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AGx03pDV6Ij |
|---|---|
| Name | (S)-3-PHENYLHEPTANOIC-ACID |
| CAS Registry Number | 61999-35-7 |
| Compound Number | 40 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C13H18O2 |
| InChI | InChI=1S/C13H18O2/c1-2-3-7-12(10-13(14)15)11-8-5-4-6-9-11/h4-6,8-9,12H,2-3,7,10H2,1H3,(H,14,15)/t12-/m0/s1 |
| InChIKey | YEUNYNJOKMJRMC-LBPRGKRZSA-N |
| Literature Reference Author | W.AMBERG,D.SEEBACH |
| Literature Reference Citation | CHEM.BER.,123,2413(1990) |
| Literature Reference DOI | 10.1002/cber.19901231225 |
| Molecular Weight | 206.285 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED12680 |