| SpectraBase Spectrum ID |
ppoXjS7Ci |
| Name |
Dill apiole |
| CAS Registry Number |
484-31-1 |
| 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 |
222.089208927 u |
| Formula |
C12H14O4 |
| 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/C12H14O4/c1-4-5-8-6-9-11(16-7-15-9)12(14-3)10(8)13-2/h4,6H,1,5,7H2,2-3H3 |
| InChIKey |
LIKYNOPXHGPMIH-UHFFFAOYSA-N |
| Molecular Weight |
222.240 g/mol |
| Nominal Mass |
222 u |
| Number of Peaks |
161 |
| SMILES |
c1(c(cc2c(c1OC)OCO2)CC=C)OC |
| SPLASH |
splash10-00di-6960000000-c6da8cfcb279214da898 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000492 |
