SpectraBase Spectrum ID |
JN9AiOG53Vw |
Name |
Butyramide, 2-phenyl-N-propyl-N-dodecyl- |
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/c1-4-7-8-9-10-11-12-13-14-18-22-26(21-5-2)25(27)24(6-3)23-19-16-15-17-20-23/h15-17,19-20,24H,4-14,18,21-22H2,1-3H3 |
InChIKey |
MJBVYLONSVNRNR-UHFFFAOYSA-N |
Molecular Weight |
373.625 g/mol |
SMILES |
C(N(CCC)CCCCCCCCCCCC)(=O)C(CC)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.935669 |