SpectraBase Compound ID | F0McCTdtA3i |
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InChI | InChI=1S/C15H33N/c1-5-8-11-12-15(4)16(13-9-6-2)14-10-7-3/h15H,5-14H2,1-4H3 |
InChIKey | ZUOAOCRCERNFAD-UHFFFAOYSA-N |
Mol Weight | 227.4 g/mol |
Molecular Formula | C15H33N |
Exact Mass | 227.2613 g/mol |
SpectraBase Spectrum ID | Juoim8i31ll |
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Name | Dibutyl(hept-2-yl)amine |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 227.261300067 u |
Formula | C15H33N |
InChI | InChI=1S/C15H33N/c1-5-8-11-12-15(4)16(13-9-6-2)14-10-7-3/h15H,5-14H2,1-4H3 |
InChIKey | ZUOAOCRCERNFAD-UHFFFAOYSA-N |
Molecular Weight | 227.436 g/mol |
SMILES | C(N(CCCC)C(CCCCC)C)CCC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.940961 |