| SpectraBase Compound ID | SRiTIviZQ9 |
|---|---|
| InChI | InChI=1S/C17H32O5/c1-13(2)15(4)22-17(19)8-6-7-16(18)21-12-10-14(3)9-11-20-5/h13-15H,6-12H2,1-5H3 |
| InChIKey | ZSUAXNXPPVZXRR-UHFFFAOYSA-N |
| Mol Weight | 316.4 g/mol |
| Molecular Formula | C17H32O5 |
| Exact Mass | 316.224974 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 85oqH1UB15w |
|---|---|
| Name | Glutaric acid, 3-methylbut-2-yl 3-methyl-5-methoxypentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 316.224974125 u |
| Formula | C17H32O5 |
| InChI | InChI=1S/C17H32O5/c1-13(2)15(4)22-17(19)8-6-7-16(18)21-12-10-14(3)9-11-20-5/h13-15H,6-12H2,1-5H3 |
| InChIKey | ZSUAXNXPPVZXRR-UHFFFAOYSA-N |
| Molecular Weight | 316.438 g/mol |
| SMILES | C(CCC(OC(C(C)C)C)=O)C(OCCC(C)CCOC)=O |