| SpectraBase Compound ID | 9HutCZPGqLo |
|---|---|
| InChI | InChI=1S/C10H16O2/c1-8(2)5-6-12-10(11)7-9(3)4/h1,3,5-7H2,2,4H3 |
| InChIKey | AYKGECXGINYBJE-UHFFFAOYSA-N |
| Mol Weight | 168.24 g/mol |
| Molecular Formula | C10H16O2 |
| Exact Mass | 168.11503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9fSU105LXqa |
|---|---|
| Name | 3-Butenoic acid, 3-methyl-, (3-methyl-3-butenyl) ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 168.115029753 u |
| Formula | C10H16O2 |
| InChI | InChI=1S/C10H16O2/c1-8(2)5-6-12-10(11)7-9(3)4/h1,3,5-7H2,2,4H3 |
| InChIKey | AYKGECXGINYBJE-UHFFFAOYSA-N |
| Molecular Weight | 168.236 g/mol |
| SMILES | C=C(CC(OCCC(=C)C)=O)C |