| SpectraBase Spectrum ID |
AWX6Y4tVFZ3 |
| Name |
Toluene |
| CAS Registry Number |
108-88-3 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
92.062600258 u |
| Formula |
C7H8 |
| InChI |
InChI=1S/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H3 |
| InChIKey |
YXFVVABEGXRONW-UHFFFAOYSA-N |
| Molecular Weight |
92.141 g/mol |
| Number of Peaks |
42 |
| RI1 |
763 |
| RI2 |
430 |
| SMILES |
c1cccc(c1)C |
| SPLASH |
splash10-0006-9000000000-c3388a7abc717a1f6e95 |
| Sample Comments |
RI1: measured on SLB-5ms (Hydro)
RI2: measured on SLB-5ms (FAMEs)
RI3: measured on Supelcowax-10 (FAMEs)
RI4: measured on Supelcowax-10 (FAEEs)
RI5: measured on Equity-1 (Hydro) |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
Benzene, methyl- |
| Wiley ID |
LM_FFNSC3_1508 |
