| SpectraBase Compound ID | FWPRaS1gE7p |
|---|---|
| InChI | InChI=1S/C19H21N3O2S/c25-19(21-16-8-12-7-15(16)14-3-1-2-13(12)14)22-20-9-11-4-5-17-18(6-11)24-10-23-17/h1,3-6,9,12-16H,2,7-8,10H2,(H2,21,22,25)/b20-9+ |
| InChIKey | CJHMCFWLAHTDNC-AWQFTUOYSA-N |
| Mol Weight | 355.46 g/mol |
| Molecular Formula | C19H21N3O2S |
| Exact Mass | 355.135448 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CLquZw0H4OV |
|---|---|
| Name | piperonal, 4-(3a,4,5,6,7,7a-hexahydro-4,7-methanoinden-5-yl)-3-thiosemicarbazone |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C19H21N3O2S |
| InChI | InChI=1S/C19H21N3O2S/c25-19(21-16-8-12-7-15(16)14-3-1-2-13(12)14)22-20-9-11-4-5-17-18(6-11)24-10-23-17/h1,3-6,9,12-16H,2,7-8,10H2,(H2,21,22,25)/b20-9+ |
| InChIKey | CJHMCFWLAHTDNC-AWQFTUOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 34516M |
| Solvent | CDCl3 |