SpectraBase Compound ID | 4osBESPLV0c |
---|---|
InChI | InChI=1S/C13H27NO2/c1-3-5-7-14(8-6-4-2)11-13-12-15-9-10-16-13/h13H,3-12H2,1-2H3 |
InChIKey | FWSHQDVTBXZMLE-UHFFFAOYSA-N |
Mol Weight | 229.36 g/mol |
Molecular Formula | C13H27NO2 |
Exact Mass | 229.204179 g/mol |
SpectraBase Spectrum ID | CJI4byZ4ell |
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Name | Dibutyl(1,4-dioxan-2-ylmethyl)amine |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 229.204179111 u |
Formula | C13H27NO2 |
InChI | InChI=1S/C13H27NO2/c1-3-5-7-14(8-6-4-2)11-13-12-15-9-10-16-13/h13H,3-12H2,1-2H3 |
InChIKey | FWSHQDVTBXZMLE-UHFFFAOYSA-N |
Molecular Weight | 229.364 g/mol |
SMILES | C(N(CCCC)CCCC)C1OCCOC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.981985 |