| SpectraBase Compound ID | LFeS91CfnJV |
|---|---|
| InChI | InChI=1S/C19H17NO3/c1-14(2)11-19(21)23-18(13-20)15-7-6-10-17(12-15)22-16-8-4-3-5-9-16/h3-12,18H,1-2H3 |
| InChIKey | LQYZNJKINKAUDK-UHFFFAOYSA-N |
| Mol Weight | 307.35 g/mol |
| Molecular Formula | C19H17NO3 |
| Exact Mass | 307.120843 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FyFTUEDCSHI |
|---|---|
| Name | .alpha.-Cyano-3-phenoxybenzyl 3-methyl-2-butenoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 307.120843408 u |
| Formula | C19H17NO3 |
| InChI | InChI=1S/C19H17NO3/c1-14(2)11-19(21)23-18(13-20)15-7-6-10-17(12-15)22-16-8-4-3-5-9-16/h3-12,18H,1-2H3 |
| InChIKey | LQYZNJKINKAUDK-UHFFFAOYSA-N |
| Molecular Weight | 307.349 g/mol |
| SMILES | C(C=C(C)C)(OC(C#N)C=1C=C(OC=2C=CC=CC2)C=CC1)=O |