![2-[(5-Methyl-2-thienyl)methylene]indane-1,3-dione](/api/spectrum/4f54qCaIOdJ/structure.png?h=300&w=458 "2-[(5-Methyl-2-thienyl)methylene]indane-1,3-dione")
| SpectraBase Compound ID | K7R3m1GJnrH |
|---|---|
| InChI | InChI=1S/C15H10O2S/c1-9-6-7-10(18-9)8-13-14(16)11-4-2-3-5-12(11)15(13)17/h2-8H,1H3 |
| InChIKey | WRQPXZIGHXVRBA-UHFFFAOYSA-N |
| Mol Weight | 254.3 g/mol |
| Molecular Formula | C15H10O2S |
| Exact Mass | 254.040151 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4f54qCaIOdJ |
|---|---|
| Name | 2-[(5-Methyl-2-thienyl)methylene]indane-1,3-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 254.040150734 u |
| Formula | C15H10O2S |
| InChI | InChI=1S/C15H10O2S/c1-9-6-7-10(18-9)8-13-14(16)11-4-2-3-5-12(11)15(13)17/h2-8H,1H3 |
| InChIKey | WRQPXZIGHXVRBA-UHFFFAOYSA-N |
| Molecular Weight | 254.303 g/mol |
| SMILES | C1(C(C=2C=CC=CC2C1=O)=O)=CC=1SC(C)=CC1 |