SpectraBase Spectrum ID |
4Jrud2qqrEd |
Name |
1-Cyclopropanecarboxamide, 2-phenyl-N-octadecyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
413.365765136 u |
Formula |
C28H47NO |
InChI |
InChI=1S/C28H47NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-29-28(30)27-24-26(27)25-21-18-17-19-22-25/h17-19,21-22,26-27H,2-16,20,23-24H2,1H3,(H,29,30) |
InChIKey |
QTVQYYOIYKQQJL-UHFFFAOYSA-N |
Molecular Weight |
413.690 g/mol |
SMILES |
C(=O)(NCCCCCCCCCCCCCCCCCC)C1C(C1)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.847248 |