SpectraBase Compound ID | OLovMOrd46 |
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InChI | InChI=1S/C15H29NO3/c1-3-5-7-9-13-19-15(18)11-12-16-14(17)10-8-6-4-2/h3-13H2,1-2H3,(H,16,17) |
InChIKey | FOTFIIGLERIXMU-UHFFFAOYSA-N |
Mol Weight | 271.4 g/mol |
Molecular Formula | C15H29NO3 |
Exact Mass | 271.214744 g/mol |
SpectraBase Spectrum ID | HHvuo8XtFmZ |
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Name | .beta.-Alanine, N-caproyl-, hexyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 271.214743795 u |
Formula | C15H29NO3 |
InChI | InChI=1S/C15H29NO3/c1-3-5-7-9-13-19-15(18)11-12-16-14(17)10-8-6-4-2/h3-13H2,1-2H3,(H,16,17) |
InChIKey | FOTFIIGLERIXMU-UHFFFAOYSA-N |
Molecular Weight | 271.401 g/mol |
SMILES | CCCCCC(NCCC(OCCCCCC)=O)=O |