SpectraBase Spectrum ID |
539ptJpjcS0 |
Name |
Butyramide, 4-(4-methoxyphenyl)-N-hexyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
277.204179111 u |
Formula |
C17H27NO2 |
InChI |
InChI=1S/C17H27NO2/c1-3-4-5-6-14-18-17(19)9-7-8-15-10-12-16(20-2)13-11-15/h10-13H,3-9,14H2,1-2H3,(H,18,19) |
InChIKey |
XFPZQYDLMSGYLJ-UHFFFAOYSA-N |
Molecular Weight |
277.408 g/mol |
SMILES |
C(C(=O)NCCCCCC)CCC1=CC=C(OC)C=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.959551 |