| SpectraBase Spectrum ID |
2hcGfj6dHyb |
| Name |
Phenyl ethyl octanoate |
| CAS Registry Number |
5457-70-5 |
| 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 |
248.177630011 u |
| Formula |
C16H24O2 |
| 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/C16H24O2/c1-2-3-4-5-9-12-16(17)18-14-13-15-10-7-6-8-11-15/h6-8,10-11H,2-5,9,12-14H2,1H3 |
| InChIKey |
ASETYIALRXDVDF-UHFFFAOYSA-N |
| Molecular Weight |
248.366 g/mol |
| Nominal Mass |
248 u |
| Number of Peaks |
85 |
| SMILES |
c1c(cccc1)CCOC(=O)CCCCCCC |
| SPLASH |
splash10-0udi-5900000000-b92c9026e3b5be7441d7 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001102 |
