| SpectraBase Spectrum ID |
74ds2DF6k8N |
| Name |
Deodarone |
| CAS Registry Number |
108645-55-2 |
| Copyright |
Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
236.177630011 u |
| Formula |
C15H24O2 |
| InChI |
InChI=1S/C15H24O2/c1-11-5-7-12(8-6-11)15(4)10-13(16)9-14(2,3)17-15/h5,12H,6-10H2,1-4H3 |
| InChIKey |
FBZSMLWLLPEEKP-UHFFFAOYSA-N |
| Molecular Weight |
236.355 g/mol |
| Number of Peaks |
50 |
| RI1 |
1695 |
| SMILES |
C1(OC(CC(C1)=O)(C)C)(C1CCC(=CC1)C)C |
| SPLASH |
splash10-000x-9300000000-db9c67054adf10bfc2a3 |
| 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 |
4H-Pyran-4-one, tetrahydro-2,2,6-trimethyl-6-(4-methyl-3-cyclohexen-1-yl)- |
| Wiley ID |
LM_FFNSC3_2121 |
