| SpectraBase Compound ID | 7OWCKDwfOlV |
|---|---|
| InChI | InChI=1S/C15H17N3OS/c1-3-4-7-11-10(2)17-18(14(11)19)15-16-12-8-5-6-9-13(12)20-15/h5-6,8-9,19H,3-4,7H2,1-2H3 |
| InChIKey | LXYOMNFVXNRHBM-UHFFFAOYSA-N |
| Mol Weight | 287.38 g/mol |
| Molecular Formula | C15H17N3OS |
| Exact Mass | 287.109233 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KSqmXEv9AjT |
|---|---|
| Name | 1H-Pyrazol-5-ol, 1-(2-benzothiazolyl)-4-butyl-3-methyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 287.109233352 u |
| Formula | C15H17N3OS |
| InChI | InChI=1S/C15H17N3OS/c1-3-4-7-11-10(2)17-18(14(11)19)15-16-12-8-5-6-9-13(12)20-15/h5-6,8-9,19H,3-4,7H2,1-2H3 |
| InChIKey | LXYOMNFVXNRHBM-UHFFFAOYSA-N |
| SMILES | OC=1N(C2=NC=3C=CC=CC3S2)N=C(C)C1CCCC |