| SpectraBase Compound ID | 6gfluYCi7sB |
|---|---|
| InChI | InChI=1S/C17H15NOS/c1-2-13(12-8-4-3-5-9-12)16(19)17-18-14-10-6-7-11-15(14)20-17/h2-11,13,16,19H,1H2/t13?,16-/m0/s1 |
| InChIKey | OPGHQCRFCNLPCN-VYIIXAMBSA-N |
| Mol Weight | 281.37 g/mol |
| Molecular Formula | C17H15NOS |
| Exact Mass | 281.087435 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Dv5yRhPbHp |
|---|---|
| Name | 1-(Benzothiazol-2'-yl)-2-phenylbut-3-en-1-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 281.087435280 u |
| Formula | C17H15NOS |
| InChI | InChI=1S/C17H15NOS/c1-2-13(12-8-4-3-5-9-12)16(19)17-18-14-10-6-7-11-15(14)20-17/h2-11,13,16,19H,1H2/t13?,16-/m0/s1 |
| InChIKey | OPGHQCRFCNLPCN-VYIIXAMBSA-N |
| SMILES | C1(=NC2=CC=CC=C2S1)[C@](C(C=C)C1=CC=CC=C1)(O)[H] |