SpectraBase Compound ID | ET05cdXntza |
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InChI | InChI=1S/C20H33NO2/c1-4-6-7-8-9-13-16-21(18(3)5-2)20(22)23-17-19-14-11-10-12-15-19/h10-12,14-15,18H,4-9,13,16-17H2,1-3H3 |
InChIKey | NBEOSOSSHUSYOY-UHFFFAOYSA-N |
Mol Weight | 319.5 g/mol |
Molecular Formula | C20H33NO2 |
Exact Mass | 319.251129 g/mol |
SpectraBase Spectrum ID | 3LuTfwA1mXp |
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Name | Carbamic acid, N-(2-butyl)-N-octyl-, benzyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 319.251129305 u |
Formula | C20H33NO2 |
InChI | InChI=1S/C20H33NO2/c1-4-6-7-8-9-13-16-21(18(3)5-2)20(22)23-17-19-14-11-10-12-15-19/h10-12,14-15,18H,4-9,13,16-17H2,1-3H3 |
InChIKey | NBEOSOSSHUSYOY-UHFFFAOYSA-N |
Molecular Weight | 319.489 g/mol |
SMILES | C(N(CCCCCCCC)C(CC)C)(=O)OCC1=CC=CC=C1 |