| SpectraBase Compound ID | gFDHUwnoQq |
|---|---|
| InChI | InChI=1S/C19H30O4/c1-15(2)7-6-8-17(5)12-14-23-19(21)10-9-18(20)22-13-11-16(3)4/h7,11-12H,6,8-10,13-14H2,1-5H3/b17-12- |
| InChIKey | FBCUFTYQYAQVRQ-ATVHPVEESA-N |
| Mol Weight | 322.45 g/mol |
| Molecular Formula | C19H30O4 |
| Exact Mass | 322.214409 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GFtGcpRep1c |
|---|---|
| Name | Succinic acid, 3-methylbut-2-en-1-yl neryl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 322.214409442 u |
| Formula | C19H30O4 |
| InChI | InChI=1S/C19H30O4/c1-15(2)7-6-8-17(5)12-14-23-19(21)10-9-18(20)22-13-11-16(3)4/h7,11-12H,6,8-10,13-14H2,1-5H3/b17-12- |
| InChIKey | FBCUFTYQYAQVRQ-ATVHPVEESA-N |
| Molecular Weight | 322.445 g/mol |
| SMILES | C(CC(OCC=C(C)C)=O)C(OC\C=C/(CCC=C(C)C)C)=O |