| SpectraBase Compound ID | 6DmAq34qzpW |
|---|---|
| InChI | InChI=1S/C14H11NOS/c16-14(7-6-13-8-9-17-11-13)15-10-12-4-2-1-3-5-12/h1-5,8-9,11H,10H2,(H,15,16) |
| InChIKey | MQTMPTCLRPIWNQ-UHFFFAOYSA-N |
| Mol Weight | 241.31 g/mol |
| Molecular Formula | C14H11NOS |
| Exact Mass | 241.056135 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 64iyiKZIPg3 |
|---|---|
| Name | N-Benzyl-3-(3-thienyl)propiolamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 241.056135151 u |
| Formula | C14H11NOS |
| InChI | InChI=1S/C14H11NOS/c16-14(7-6-13-8-9-17-11-13)15-10-12-4-2-1-3-5-12/h1-5,8-9,11H,10H2,(H,15,16) |
| InChIKey | MQTMPTCLRPIWNQ-UHFFFAOYSA-N |
| Molecular Weight | 241.308 g/mol |
| SMILES | C(#CC1=CSC=C1)C(NCC=1C=CC=CC1)=O |