SpectraBase Compound ID | 5NXpKT8FvYL |
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InChI | InChI=1S/C13H18O3/c1-2-3-4-7-10-16-13(15)11-8-5-6-9-12(11)14/h5-6,8-9,14H,2-4,7,10H2,1H3 |
InChIKey | DUKPKQFHJQGTGU-UHFFFAOYSA-N |
Mol Weight | 222.28 g/mol |
Molecular Formula | C13H18O3 |
Exact Mass | 222.125594 g/mol |
SpectraBase Spectrum ID | 4ASZnSowzEO |
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Name | Hexyl salicylate |
Comments | MONAID: JP005809 |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C13H18O3 |
InChI | InChI=1S/C13H18O3/c1-2-3-4-7-10-16-13(15)11-8-5-6-9-12(11)14/h5-6,8-9,14H,2-4,7,10H2,1H3 |
InChIKey | DUKPKQFHJQGTGU-UHFFFAOYSA-N |
Ionization Type | EI-B |
Molecular Weight | 222.284 g/mol |
SMILES | Oc1c(C(OCCCCCC)=O)cccc1 |
SPLASH | splash10-00di-4910000000-5a492eead1ac44c9f76d |
Source of Spectrum | SRH-2022-5809-0 |
Wiley ID | 1827813 |