| SpectraBase Compound ID | M7Ql5wSFnd |
|---|---|
| InChI | InChI=1S/C29H56O4/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-32-28(30)22-23-29(31)33-26-24-27(3)5-2/h27H,4-26H2,1-3H3 |
| InChIKey | WKLJTOQLYOZHNV-UHFFFAOYSA-N |
| Mol Weight | 468.8 g/mol |
| Molecular Formula | C29H56O4 |
| Exact Mass | 468.41786 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 60ONRjdMbEC |
|---|---|
| Name | Succinic acid, 3-methylpentyl nonadecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 468.417860279 u |
| Formula | C29H56O4 |
| InChI | InChI=1S/C29H56O4/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-32-28(30)22-23-29(31)33-26-24-27(3)5-2/h27H,4-26H2,1-3H3 |
| InChIKey | WKLJTOQLYOZHNV-UHFFFAOYSA-N |
| Molecular Weight | 468.763 g/mol |
| SMILES | C(CC(OCCC(C)CC)=O)C(OCCCCCCCCCCCCCCCCCCC)=O |