| SpectraBase Spectrum ID |
KoIk3j9ZwIC |
| Name |
Magnolan, (1RS,3RS,4aSR,9aRS) |
| CAS Registry Number |
27606-09-3 |
| 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 |
204.115029753 u |
| Formula |
C13H16O2 |
| InChI |
InChI=1S/C13H16O2/c1-8-12-7-10-5-3-4-6-11(10)13(12)15-9(2)14-8/h3-6,8-9,12-13H,7H2,1-2H3 |
| InChIKey |
SHWFPOIJJLMZKA-UHFFFAOYSA-N |
| Molecular Weight |
204.269 g/mol |
| Number of Peaks |
50 |
| RI1 |
1526 |
| RI2 |
1202 |
| RI3 |
1880 |
| RI4 |
1840 |
| RI5 |
1492 |
| SMILES |
CC1OC(C2C(O1)c1ccccc1C2)C |
| SPLASH |
splash10-014l-2900000000-229388f07df090f881fd |
| 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 |
Indeno[1,2-d]-1,3-dioxin,4a,5,9b-tetrahydro-2,4-dimethyl-, (1RS,3RS,4aSR,9aRS) |
| Wiley ID |
LM_FFNSC3_3349 |
