| SpectraBase Compound ID | DDTGXXo329D |
|---|---|
| InChI | InChI=1S/C14H17NO6/c15-6-9(8-4-2-1-3-5-8)20-14-13(19)12(18)11(17)10(7-16)21-14/h1-5,9-14,16-19H,7H2/t9-,10-,11-,12+,13-,14-/m0/s1 |
| InChIKey | ZKSZEJFBGODIJW-GAURVVSWSA-N |
| Mol Weight | 295.29 g/mol |
| Molecular Formula | C14H17NO6 |
| Exact Mass | 295.105587 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LQroJbIs1AO |
|---|---|
| Name | PRUNASIN;2-BETA-D-GLUCOPYRANOSYLOXY-2-PHENYLACETONITRILE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C14H17NO6 |
| InChI | InChI=1S/C14H17NO6/c15-6-9(8-4-2-1-3-5-8)20-14-13(19)12(18)11(17)10(7-16)21-14/h1-5,9-14,16-19H,7H2/t9-,10-,11-,12+,13-,14-/m0/s1 |
| InChIKey | ZKSZEJFBGODIJW-GAURVVSWSA-N |
| Literature Reference Author | A.NAHRSTEDT,J.ROCKENBACH |
| Literature Reference Citation | PHYTOCHEM.,34,433(1993) |
| Literature Reference DOI | 10.1016/0031-9422(93)80024-M |
| Molecular Weight | 295.292 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU7301 |