| SpectraBase Compound ID | 6b3edkckYgC |
|---|---|
| InChI | InChI=1S/C17H30O2/c1-5-6-7-8-9-10-11-12-13-17(18)19-16(4)14-15(2)3/h1,15-16H,6-14H2,2-4H3 |
| InChIKey | BYXWOWQRJAMVFW-UHFFFAOYSA-N |
| Mol Weight | 266.42 g/mol |
| Molecular Formula | C17H30O2 |
| Exact Mass | 266.22458 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FYyEUdn8x2H |
|---|---|
| Name | Undec-10-ynoic acid, 4-methyl-2-pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 266.224580204 u |
| Formula | C17H30O2 |
| InChI | InChI=1S/C17H30O2/c1-5-6-7-8-9-10-11-12-13-17(18)19-16(4)14-15(2)3/h1,15-16H,6-14H2,2-4H3 |
| InChIKey | BYXWOWQRJAMVFW-UHFFFAOYSA-N |
| Molecular Weight | 266.425 g/mol |
| SMILES | C(CCCC(OC(CC(C)C)C)=O)CCCCC#C |