SpectraBase Spectrum ID |
GV1bqH1CvlD |
Name |
Propionamide, 3-cyclopentyl-N-benzyl-N-methyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
245.177964364 u |
Formula |
C16H23NO |
InChI |
InChI=1S/C16H23NO/c1-17(13-15-9-3-2-4-10-15)16(18)12-11-14-7-5-6-8-14/h2-4,9-10,14H,5-8,11-13H2,1H3 |
InChIKey |
XZRPVJVIAGATLZ-UHFFFAOYSA-N |
Molecular Weight |
245.366 g/mol |
SMILES |
C(N(C)CC1=CC=CC=C1)(=O)CCC1CCCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.834519 |