SpectraBase Spectrum ID |
IeyKnPM2sTY |
Name |
Propanamide, 2-bromo-N-(2-phenylethyl)-N-octyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
367.151077589 u |
Formula |
C19H30BrNO |
InChI |
InChI=1S/C19H30BrNO/c1-3-4-5-6-7-11-15-21(19(22)17(2)20)16-14-18-12-9-8-10-13-18/h8-10,12-13,17H,3-7,11,14-16H2,1-2H3 |
InChIKey |
CBMNBZPTXZKHMW-UHFFFAOYSA-N |
Molecular Weight |
368.359 g/mol |
SMILES |
C1=CC=CC(=C1)CCN(C(=O)C(Br)C)CCCCCCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.956073 |