| SpectraBase Spectrum ID |
3EnJEFgSJYo |
| Name |
Toluene |
| Source of Sample |
Sigma-Aldrich Company LLC |
| Catalog Number |
179418 |
| Lot Number |
SHBF7905V |
| Boiling Point |
110.0 - 111.0 °C |
| CAS Registry Number |
108-88-3 |
| Compound Type |
Pure |
| Copyright |
Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Density |
0.865 g/cm³ |
| Formula |
C7H8 |
| InChI |
InChI=1S/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H3 |
| InChIKey |
YXFVVABEGXRONW-UHFFFAOYSA-N |
| Melting Point |
-93.0 °C |
| Molecular Weight |
92.141 g/mol |
| Purity |
99.5% |
| Raman Corrections |
Referenced to internal white light source; 180 degree backscatter |
| Raman Laser Source |
Nd:YAG |
| SMILES |
c1cccc(c1)C |
| Source of Spectrum |
Forensic Spectral Research |
| Synonyms |
Methylbenzene; Phenylmethane |
| Technique |
FT-Raman |
