SpectraBase Compound ID | 2OGAfZ8ysX2 |
---|---|
InChI | InChI=1S/C13H19NO/c1-3-12(2)14(11-15)10-9-13-7-5-4-6-8-13/h4-8,11-12H,3,9-10H2,1-2H3 |
InChIKey | RUOMUKPMPCYQFX-UHFFFAOYSA-N |
Mol Weight | 205.3 g/mol |
Molecular Formula | C13H19NO |
Exact Mass | 205.146664 g/mol |
SpectraBase Spectrum ID | JqUCu4H4Kw4 |
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Name | N-2-Butyl-N-phenethylformamide |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 205.146664235 u |
Formula | C13H19NO |
InChI | InChI=1S/C13H19NO/c1-3-12(2)14(11-15)10-9-13-7-5-4-6-8-13/h4-8,11-12H,3,9-10H2,1-2H3 |
InChIKey | RUOMUKPMPCYQFX-UHFFFAOYSA-N |
Molecular Weight | 205.301 g/mol |
SMILES | C(N(C=O)CCC=1C=CC=CC1)(CC)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.913727 |