| SpectraBase Compound ID | 8IsfZC2Nnv3 |
|---|---|
| InChI | InChI=1S/C13H18O3/c1-10(8-13(15)16-2)7-11-5-3-4-6-12(11)9-14/h3-6,10,14H,7-9H2,1-2H3 |
| InChIKey | BGLWOIWBUDPPNO-UHFFFAOYSA-N |
| Mol Weight | 222.28 g/mol |
| Molecular Formula | C13H18O3 |
| Exact Mass | 222.125594 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9H87XxTuO8k |
|---|---|
| Name | Methyl 4-(2-hydroxymethylphenyl)-3-methylbutanoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H18O3 |
| InChI | InChI=1S/C13H18O3/c1-10(8-13(15)16-2)7-11-5-3-4-6-12(11)9-14/h3-6,10,14H,7-9H2,1-2H3 |
| InChIKey | BGLWOIWBUDPPNO-UHFFFAOYSA-N |
| Molecular Weight | 222.284 g/mol |
| SMILES | OCc1c(CC(CC(=O)OC)C)cccc1 |
| SPLASH | splash10-001l-6910000000-5d722b59fa4baa78f617 |
| Source of Spectrum | KC-57-5803-20 |
| Wiley ID | 1624871 |