SpectraBase Compound ID | 6fNyNMilYQF |
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InChI | InChI=1S/C21H35NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-21(23)24-19-20-15-14-17-22-18-20/h14-15,17-18H,2-13,16,19H2,1H3 |
InChIKey | UTNGTSRXVAVXCM-UHFFFAOYSA-N |
Mol Weight | 333.5 g/mol |
Molecular Formula | C21H35NO2 |
Exact Mass | 333.266779 g/mol |
SpectraBase Spectrum ID | 643XbRPKA39 |
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Name | (3-Pyridyl)methyl pentadecanoate |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 333.266779369 u |
Formula | C21H35NO2 |
InChI | InChI=1S/C21H35NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-21(23)24-19-20-15-14-17-22-18-20/h14-15,17-18H,2-13,16,19H2,1H3 |
InChIKey | UTNGTSRXVAVXCM-UHFFFAOYSA-N |
Molecular Weight | 333.516 g/mol |
SMILES | C1(=CC=CN=C1)COC(CCCCCCCCCCCCCC)=O |