| SpectraBase Compound ID | A3SmKXZOvfC |
|---|---|
| InChI | InChI=1S/C9H9NO2/c11-10(12)9-6-2-4-7-3-1-5-8(7)9/h2,4,6H,1,3,5H2 |
| InChIKey | ZQABKMBXKCJTPM-UHFFFAOYSA-N |
| Mol Weight | 163.18 g/mol |
| Molecular Formula | C9H9NO2 |
| Exact Mass | 163.063329 g/mol |
13C Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | F2NpeJ9qOUe |
|---|---|
| Name | 4-Nitroindan |
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Catalog Number | 515035 |
| Copyright | Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H9NO2 |
| InChI | InChI=1S/C9H9NO2/c11-10(12)9-6-2-4-7-3-1-5-8(7)9/h2,4,6H,1,3,5H2 |
| InChIKey | ZQABKMBXKCJTPM-UHFFFAOYSA-N |
| Molecular Weight | 163.176 g/mol |
| Observed nucleus | 13C |
| Purity | 99% |
| Solvent | CDCl3 |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Wiley ID | SIAL_13CNMR_015025 |