SpectraBase Spectrum ID |
BcdFpxN4hlb |
Name |
4-[3-Ethoxy-5-phenyl-2-[(E)-1-phenylprop-1-enyl]-1-cyclopenta-2,4-dienyl]morpholine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
387.219829176 u |
Formula |
C26H29NO2 |
InChI |
InChI=1S/C26H29NO2/c1-3-22(20-11-7-5-8-12-20)25-24(29-4-2)19-23(21-13-9-6-10-14-21)26(25)27-15-17-28-18-16-27/h3,5-14,19,26H,4,15-18H2,1-2H3/b22-3+ |
InChIKey |
CVIYDXKQJCKJDF-HEQWTUPCSA-N |
Molecular Weight |
387.523 g/mol |
SMILES |
C=1(C(C(C2=CC=CC=C2)=CC1OCC)N1CCOCC1)\C(C=1C=CC=CC1)=C\C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.826305 |