SpectraBase Spectrum ID |
L78fTlB53p6 |
Name |
Butyramide, 2-phenyl-N-(2-butyl)-N-undecyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
373.334465008 u |
Formula |
C25H43NO |
InChI |
InChI=1S/C25H43NO/c1-5-8-9-10-11-12-13-14-18-21-26(22(4)6-2)25(27)24(7-3)23-19-16-15-17-20-23/h15-17,19-20,22,24H,5-14,18,21H2,1-4H3 |
InChIKey |
OCYMPUMNPNABRE-UHFFFAOYSA-N |
Molecular Weight |
373.625 g/mol |
SMILES |
C(N(CCCCCCCCCCC)C(CC)C)(=O)C(CC)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.827121 |