| SpectraBase Compound ID | 3eF4ZueyGup |
|---|---|
| InChI | InChI=1S/C7H5N3O6/c1-4-6(9(13)14)2-5(8(11)12)3-7(4)10(15)16/h2-3H,1H3 |
| InChIKey | SPSSULHKWOKEEL-UHFFFAOYSA-N |
| Mol Weight | 227.13 g/mol |
| Molecular Formula | C7H5N3O6 |
| Exact Mass | 227.017835 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 18mvjtFlFSl |
|---|---|
| Name | 2,4,6-Trinitrotoluene |
| CAS Registry Number | 118-96-7 |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H5N3O6 |
| InChI | InChI=1S/C7H5N3O6/c1-4-6(9(13)14)2-5(8(11)12)3-7(4)10(15)16/h2-3H,1H3 |
| InChIKey | SPSSULHKWOKEEL-UHFFFAOYSA-N |
| Instrument Name | Varian A-60D |
| Sadtler NMR Number | 18215M |
| Solvent | Polysol |
| Synonyms | TNT |