SpectraBase Spectrum ID |
GzfokzEHOXu |
Name |
Butyramide, 3-methyl-N-(2-phenylethyl)-N-propyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
247.193614428 u |
Formula |
C16H25NO |
InChI |
InChI=1S/C16H25NO/c1-4-11-17(16(18)13-14(2)3)12-10-15-8-6-5-7-9-15/h5-9,14H,4,10-13H2,1-3H3 |
InChIKey |
GUFGOLNKBKLPBG-UHFFFAOYSA-N |
Molecular Weight |
247.382 g/mol |
SMILES |
C1=CC=CC(=C1)CCN(C(=O)CC(C)C)CCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.957551 |