| SpectraBase Spectrum ID |
Ea9MT8YRi2U |
| Name |
Mefranal |
| CAS Registry Number |
55066-49-4 |
| 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 |
176.120115134 u |
| Formula |
C12H16O |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness) |
| GC Oven Program |
60 °C to 246 °C at 3 °C/min. |
| InChI |
InChI=1S/C12H16O/c1-11(9-10-13)7-8-12-5-3-2-4-6-12/h2-6,10-11H,7-9H2,1H3 |
| InChIKey |
DFJMIMVMOIFPQG-UHFFFAOYSA-N |
| Molecular Weight |
176.259 g/mol |
| Nominal Mass |
176 u |
| Number of Peaks |
101 |
| SMILES |
C(CC(CCc1ccccc1)C)=O |
| SPLASH |
splash10-0006-9400000000-d55e91f959d529ed670e |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000889 |
