| SpectraBase Spectrum ID |
GZIn2bt4OuU |
| Name |
Hexahydrotoluene |
| CAS Registry Number |
108-87-2 |
| 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 |
98.109550451 u |
| Formula |
C7H14 |
| InChI |
InChI=1S/C7H14/c1-7-5-3-2-4-6-7/h7H,2-6H2,1H3 |
| InChIKey |
UAEPNZWRGJTJPN-UHFFFAOYSA-N |
| Molecular Weight |
98.189 g/mol |
| Number of Peaks |
49 |
| RI1 |
725 |
| RI2 |
406 |
| SMILES |
C1CCCC(C1)C |
| SPLASH |
splash10-0a5c-9000000000-3429944862231e810b0a |
| 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 |
Cyclohexane, methyl- |
| Wiley ID |
LM_FFNSC3_1604 |
