| SpectraBase Compound ID | J20CUv3BpUp |
|---|---|
| InChI | InChI=1S/C10H16O2/c1-3-5-7-9(10(11)12)8-6-4-2/h1,9H,4-8H2,2H3,(H,11,12) |
| InChIKey | DBNFIUJIYOUBQC-UHFFFAOYSA-N |
| Mol Weight | 168.24 g/mol |
| Molecular Formula | C10H16O2 |
| Exact Mass | 168.11503 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KynUEGz5Yu3 |
|---|---|
| Name | 2-Butylhex-5-ynoic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H16O2 |
| InChI | InChI=1S/C10H16O2/c1-3-5-7-9(10(11)12)8-6-4-2/h1,9H,4-8H2,2H3,(H,11,12) |
| InChIKey | DBNFIUJIYOUBQC-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1021/ol9015578 |
| Molecular Weight | 168.236 g/mol |
| SMILES | OC(C(CCC#C)CCCC)=O |
| SPLASH | splash10-05fr-9000000000-b56f1253d514f179f0f6 |
| Source of Spectrum | A1-11-4084/SMS9-15h |
| Wiley ID | 1757284 |