| SpectraBase Spectrum ID |
9lSh3MttKtE |
| Name |
Troenan isomer I |
| CAS Registry Number |
80480-24-6 |
| 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 |
214.193280075 u |
| Formula |
C13H26O2 |
| InChI |
InChI=1S/C13H26O2/c1-5-7-11(3)12-14-9-13(4,8-6-2)10-15-12/h11-12H,5-10H2,1-4H3 |
| InChIKey |
LODLFUCEWWWXPR-UHFFFAOYSA-N |
| Molecular Weight |
214.349 g/mol |
| Number of Peaks |
50 |
| RI1 |
1352 |
| RI2 |
1030 |
| RI3 |
1167 |
| RI4 |
1123 |
| SMILES |
CC1(COC(OC1)C(CCC)C)CCC |
| SPLASH |
splash10-0a4l-9200000000-e0ff3079f84cb1db79c9 |
| 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 |
1,3-Dioxane, 5-methyl-2-(1-methylbutyl)-5-propyl |
| Wiley ID |
LM_FFNSC3_3307 |
