| SpectraBase Compound ID | BuMrYXxCSAr |
|---|---|
| InChI | InChI=1S/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H3 |
| InChIKey | YXFVVABEGXRONW-UHFFFAOYSA-N |
| Mol Weight | 92.14 g/mol |
| Molecular Formula | C7H8 |
| Exact Mass | 92.0626 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FtBnccofSnS |
|---|---|
| Name | TOLUENE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C7H8 |
| InChI | InChI=1S/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H3 |
| InChIKey | YXFVVABEGXRONW-UHFFFAOYSA-N |
| Literature Reference Author | H.E.GOTTLIEB,V.KOTLYAR,A.NUDELMAN |
| Literature Reference Citation | J.ORG.CHEM.,62,7512(1997) |
| Literature Reference DOI | 10.1021/jo971176v |
| Molecular Weight | 92.141 g/mol |
| Solvent | ACETONE-D6 |
| Source File Reference | UWMZ5203 |