![2-Phenyl-2,4,6,7-tetrahydrothiopyrano[4,3-C]pyrazol-3ol](/api/spectrum/4ELgsqUSzCk/structure.png?h=300&w=458 "2-Phenyl-2,4,6,7-tetrahydrothiopyrano[4,3-C]pyrazol-3ol")
| SpectraBase Compound ID | E35LWSAhfkC |
|---|---|
| InChI | InChI=1S/C12H12N2OS/c15-12-10-8-16-7-6-11(10)13-14(12)9-4-2-1-3-5-9/h1-5,15H,6-8H2 |
| InChIKey | MASZAOSZWCGATM-UHFFFAOYSA-N |
| Mol Weight | 232.3 g/mol |
| Molecular Formula | C12H12N2OS |
| Exact Mass | 232.067034 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4ELgsqUSzCk |
|---|---|
| Name | 2-Phenyl-2,4,6,7-tetrahydrothiopyrano[4,3-C]pyrazol-3ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 232.067034187 u |
| Formula | C12H12N2OS |
| InChI | InChI=1S/C12H12N2OS/c15-12-10-8-16-7-6-11(10)13-14(12)9-4-2-1-3-5-9/h1-5,15H,6-8H2 |
| InChIKey | MASZAOSZWCGATM-UHFFFAOYSA-N |
| Molecular Weight | 232.301 g/mol |
| SMILES | OC=1N(N=C2CCSCC12)C=1C=CC=CC1 |