| SpectraBase Spectrum ID |
D5XMbgMcM9N |
| Name |
Octanedioic acid, diethyl ester |
| CAS Registry Number |
2050-23-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H22O4 |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness) |
| GC Oven Program |
60 ??C to 246 ??C at 3 ??C/min. |
| InChI |
InChI=1S/C12H22O4/c1-3-15-11(13)9-7-5-6-8-10-12(14)16-4-2/h3-10H2,1-2H3 |
| InChIKey |
PEUGOJXLBSIJQS-UHFFFAOYSA-N |
| Molecular Weight |
230.304 g/mol |
| SMILES |
CCOC(CCCCCCC(OCC)=O)=O |
| SPLASH |
splash10-052o-9400000000-d3f34197823f108ff302 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
1887727 |
