![(R*,R*) and (R*,S*)-2-[3-Butyl-1-hydroxyprop-2-ynyl]pentan-5-olide](/api/spectrum/49d5RkycgED/structure.png?h=300&w=458 "(R*,R*) and (R*,S*)-2-[3-Butyl-1-hydroxyprop-2-ynyl]pentan-5-olide")
| SpectraBase Compound ID | 3Q5t1EKwMks |
|---|---|
| InChI | InChI=1S/C12H18O3/c1-2-3-4-5-8-11(13)10-7-6-9-15-12(10)14/h10-11,13H,2-4,6-7,9H2,1H3 |
| InChIKey | PNDMXQQVLKSQAR-UHFFFAOYSA-N |
| Mol Weight | 210.27 g/mol |
| Molecular Formula | C12H18O3 |
| Exact Mass | 210.125594 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 49d5RkycgED |
|---|---|
| Name | (R*,R*) and (R*,S*)-2-[3-Butyl-1-hydroxyprop-2-ynyl]pentan-5-olide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H18O3 |
| InChI | InChI=1S/C12H18O3/c1-2-3-4-5-8-11(13)10-7-6-9-15-12(10)14/h10-11,13H,2-4,6-7,9H2,1H3 |
| InChIKey | PNDMXQQVLKSQAR-UHFFFAOYSA-N |
| Molecular Weight | 210.273 g/mol |
| SMILES | OC(C#CCCCC)C1C(OCCC1)=O |
| SPLASH | splash10-0udi-0900000000-c7f62789386a3142ad0a |
| Source of Spectrum | KC-0-144-8 |
| Wiley ID | 775813 |