| SpectraBase Compound ID | FPs3y62fhbx |
|---|---|
| InChI | InChI=1S/C16H32O2/c1-4-5-6-7-8-9-10-11-12-13-18-16(17)14-15(2)3/h15H,4-14H2,1-3H3 |
| InChIKey | ITSQZEZOZHBTQN-UHFFFAOYSA-N |
| Mol Weight | 256.4 g/mol |
| Molecular Formula | C16H32O2 |
| Exact Mass | 256.24023 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 | IqZNapDq5go |
|---|---|
| Name | Isovaleric acid, undecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 256.240230268 u |
| Formula | C16H32O2 |
| InChI | InChI=1S/C16H32O2/c1-4-5-6-7-8-9-10-11-12-13-18-16(17)14-15(2)3/h15H,4-14H2,1-3H3 |
| InChIKey | ITSQZEZOZHBTQN-UHFFFAOYSA-N |
| Molecular Weight | 256.430 g/mol |
| SMILES | CC(C)CC(OCCCCCCCCCCC)=O |