| SpectraBase Compound ID | 4lirBNmA3gB |
|---|---|
| InChI | InChI=1S/C19H20S/c1-3-11-17(12-4-1)19(15-16-9-7-8-10-16)20-18-13-5-2-6-14-18/h1-6,11-16H,7-10H2/b19-15- |
| InChIKey | LDSXILRXFSJXQA-CYVLTUHYSA-N |
| Mol Weight | 280.43 g/mol |
| Molecular Formula | C19H20S |
| Exact Mass | 280.128572 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GNr7XOszigu |
|---|---|
| Name | (Z)-1-(Phenylthio)-2-cyclopentylstyrene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 280.128571818 u |
| Formula | C19H20S |
| InChI | InChI=1S/C19H20S/c1-3-11-17(12-4-1)19(15-16-9-7-8-10-16)20-18-13-5-2-6-14-18/h1-6,11-16H,7-10H2/b19-15- |
| InChIKey | LDSXILRXFSJXQA-CYVLTUHYSA-N |
| SMILES | C1(\C(=C\C2CCCC2)SC2=CC=CC=C2)=CC=CC=C1 |