SpectraBase Spectrum ID |
KvfTcPqKNdK |
Name |
4-[2-(3-Methyl-2,2-diphenylcyclopropyl)ethyl]morpholine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
321.209264492 u |
Formula |
C22H27NO |
InChI |
InChI=1S/C22H27NO/c1-18-21(12-13-23-14-16-24-17-15-23)22(18,19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-11,18,21H,12-17H2,1H3 |
InChIKey |
HHRRRVKESYSQKM-UHFFFAOYSA-N |
Molecular Weight |
321.464 g/mol |
SMILES |
C1(C(CCN2CCOCC2)C1C)(C=1C=CC=CC1)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.839376 |