![Phenanthro[4,3-B]thiophene](/api/spectrum/14W8kt2bIIb/structure.png?h=300&w=458 "Phenanthro[4,3-B]thiophene")
| SpectraBase Compound ID | 4qO1Gq8spsE |
|---|---|
| InChI | InChI=1S/C16H10S/c1-2-4-14-11(3-1)5-6-12-7-8-13-9-10-17-16(13)15(12)14/h1-10H |
| InChIKey | HVDXWEZIEYUOMI-UHFFFAOYSA-N |
| Mol Weight | 234.32 g/mol |
| Molecular Formula | C16H10S |
| Exact Mass | 234.050321 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 14W8kt2bIIb |
|---|---|
| Name | Phenanthro[4,3-B]thiophene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 234.050321496 u |
| Formula | C16H10S |
| InChI | InChI=1S/C16H10S/c1-2-4-14-11(3-1)5-6-12-7-8-13-9-10-17-16(13)15(12)14/h1-10H |
| InChIKey | HVDXWEZIEYUOMI-UHFFFAOYSA-N |
| Molecular Weight | 234.316 g/mol |
| SMILES | C1=CC=CC2=C1C=CC1=C2C2=C(C=CS2)C=C1 |