| SpectraBase Compound ID | LMiQyOSQUjV |
|---|---|
| InChI | InChI=1S/C14H17NOS2/c1-3-4-9-17-14-15-13(10-18-14)11-5-7-12(16-2)8-6-11/h5-8,10H,3-4,9H2,1-2H3 |
| InChIKey | DVFQPMIOLOFGET-UHFFFAOYSA-N |
| Mol Weight | 279.42 g/mol |
| Molecular Formula | C14H17NOS2 |
| Exact Mass | 279.075157 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L1CX2Wh7LPw |
|---|---|
| Name | Thiazole, 2-(butylthio)-4-(4-methoxyphenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 279.075156518 u |
| Formula | C14H17NOS2 |
| InChI | InChI=1S/C14H17NOS2/c1-3-4-9-17-14-15-13(10-18-14)11-5-7-12(16-2)8-6-11/h5-8,10H,3-4,9H2,1-2H3 |
| InChIKey | DVFQPMIOLOFGET-UHFFFAOYSA-N |
| SMILES | C(SC1=NC(C2=CC=C(C=C2)OC)=CS1)CCC |