| SpectraBase Compound ID | CcvWTOv7Smg |
|---|---|
| InChI | InChI=1S/C15H16O2S/c16-15(12-14-9-5-11-18-14)17-10-4-8-13-6-2-1-3-7-13/h1-3,5-7,9,11H,4,8,10,12H2 |
| InChIKey | KBURXMHHGGDMTJ-UHFFFAOYSA-N |
| Mol Weight | 260.35 g/mol |
| Molecular Formula | C15H16O2S |
| Exact Mass | 260.087101 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 7DWIpnjzfQ9 |
|---|---|
| Name | 2-Thiopheneacetic acid, 3-phenylpropyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 260.087100927 u |
| Formula | C15H16O2S |
| InChI | InChI=1S/C15H16O2S/c16-15(12-14-9-5-11-18-14)17-10-4-8-13-6-2-1-3-7-13/h1-3,5-7,9,11H,4,8,10,12H2 |
| InChIKey | KBURXMHHGGDMTJ-UHFFFAOYSA-N |
| Molecular Weight | 260.351 g/mol |
| SMILES | C1=CC=CC=C1CCCOC(=O)CC=1SC=CC1 |