| SpectraBase Spectrum ID |
8X59A2EKsFq |
| Name |
Furfuryl butanoate |
| CAS Registry Number |
623-21-2 |
| 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 |
168.078644243 u |
| Formula |
C9H12O3 |
| 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/C9H12O3/c1-2-4-9(10)12-7-8-5-3-6-11-8/h3,5-6H,2,4,7H2,1H3 |
| InChIKey |
IXISGRHWGVGCAK-UHFFFAOYSA-N |
| Molecular Weight |
168.192 g/mol |
| Nominal Mass |
168 u |
| Number of Peaks |
70 |
| SMILES |
CCCC(=O)OCc1occc1 |
| SPLASH |
splash10-001i-9000000000-95641a65d539e8964a34 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001639 |
