| SpectraBase Compound ID | 9scJjJ19qBr |
|---|---|
| InChI | InChI=1S/C13H24O3/c1-3-5-7-8-9-10-12-16-13(14)15-11-6-4-2/h4H,2-3,5-12H2,1H3 |
| InChIKey | VLBCFEVGRUTYNX-UHFFFAOYSA-N |
| Mol Weight | 228.33 g/mol |
| Molecular Formula | C13H24O3 |
| Exact Mass | 228.172545 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | JBx8c8tdqWM |
|---|---|
| Name | Carbonic acid, but-3-en-1-yl octyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 228.172544630 u |
| Formula | C13H24O3 |
| InChI | InChI=1S/C13H24O3/c1-3-5-7-8-9-10-12-16-13(14)15-11-6-4-2/h4H,2-3,5-12H2,1H3 |
| InChIKey | VLBCFEVGRUTYNX-UHFFFAOYSA-N |
| Molecular Weight | 228.332 g/mol |
| SMILES | C(OCCCCCCCC)(=O)OCCC=C |