SpectraBase Spectrum ID |
4VqxRZAmSdA |
Name |
Butyramide, 4-phenyl-N-(2-ethylhexyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
275.224914557 u |
Formula |
C18H29NO |
InChI |
InChI=1S/C18H29NO/c1-3-5-10-16(4-2)15-19-18(20)14-9-13-17-11-7-6-8-12-17/h6-8,11-12,16H,3-5,9-10,13-15H2,1-2H3,(H,19,20) |
InChIKey |
ZTFFENIXMPYJRP-UHFFFAOYSA-N |
SMILES |
C(NCC(CCCC)CC)(=O)CCCC1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.936102 |