| SpectraBase Compound ID | 23Y1m50wqT1 |
|---|---|
| InChI | InChI=1S/C13H17ClO2/c1-3-4-9-13(15)16-10(2)11-7-5-6-8-12(11)14/h5-8,10H,3-4,9H2,1-2H3 |
| InChIKey | BBLJJIUEKWYVRN-UHFFFAOYSA-N |
| Mol Weight | 240.73 g/mol |
| Molecular Formula | C13H17ClO2 |
| Exact Mass | 240.091707 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9I5jzQBghJb |
|---|---|
| Name | 1-(2-Chlorophenyl)ethanol valerate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H17ClO2 |
| InChI | InChI=1S/C13H17ClO2/c1-3-4-9-13(15)16-10(2)11-7-5-6-8-12(11)14/h5-8,10H,3-4,9H2,1-2H3 |
| InChIKey | BBLJJIUEKWYVRN-UHFFFAOYSA-N |
| Molecular Weight | 240.730 g/mol |
| SMILES | c1(C(OC(=O)CCCC)C)c(Cl)cccc1 |
| SPLASH | splash10-0udr-2930000000-3f4dd1bc5a6fd34ef169 |
| Source of Spectrum | QC-22-1377-5i |
| Wiley ID | 1691453 |