![1-Methylnaphtho[2,3-E]benzothiophene](/api/spectrum/sQLfrg0E5c/structure.png?h=300&w=458 "1-Methylnaphtho[2,3-E]benzothiophene")
| SpectraBase Compound ID | EILUMGcDYrm |
|---|---|
| InChI | InChI=1S/C17H12S/c1-11-10-18-16-7-6-14-8-12-4-2-3-5-13(12)9-15(14)17(11)16/h2-10H,1H3 |
| InChIKey | ATNNEKZLGVHIPV-UHFFFAOYSA-N |
| Mol Weight | 248.34 g/mol |
| Molecular Formula | C17H12S |
| Exact Mass | 248.065972 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | sQLfrg0E5c |
|---|---|
| Name | 1-Methylnaphtho[2,3-E]benzothiophene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 248.065971560 u |
| Formula | C17H12S |
| InChI | InChI=1S/C17H12S/c1-11-10-18-16-7-6-14-8-12-4-2-3-5-13(12)9-15(14)17(11)16/h2-10H,1H3 |
| InChIKey | ATNNEKZLGVHIPV-UHFFFAOYSA-N |
| Molecular Weight | 248.343 g/mol |
| SMILES | C12=C3C(=CSC3=CC=C1C=C1C=CC=CC1=C2)C |