| SpectraBase Spectrum ID |
HQNAbjxupQ5 |
| Name |
Furfuryl octanoate |
| CAS Registry Number |
39252-03-4 |
| 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 |
224.141244501 u |
| Formula |
C13H20O3 |
| 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/C13H20O3/c1-2-3-4-5-6-9-13(14)16-11-12-8-7-10-15-12/h7-8,10H,2-6,9,11H2,1H3 |
| InChIKey |
JNIWCVWKECYDSV-UHFFFAOYSA-N |
| Molecular Weight |
224.300 g/mol |
| Nominal Mass |
224 u |
| Number of Peaks |
133 |
| SMILES |
c1oc(cc1)COC(=O)CCCCCCC |
| SPLASH |
splash10-001i-9100000000-735b530da875b06f4240 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001643 |
