SpectraBase Spectrum ID |
2qdZy8r31L4 |
Name |
6-Methyl-4,5-tetramethylene-6-ethyl-2-phenyl-5,6-dihydro-4H-1,3-oxazine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
257.177964364 u |
Formula |
C17H23NO |
InChI |
InChI=1S/C17H23NO/c1-3-17(2)14-11-7-8-12-15(14)18-16(19-17)13-9-5-4-6-10-13/h4-6,9-10,14-15H,3,7-8,11-12H2,1-2H3 |
InChIKey |
CRZRZHDPIIKETA-UHFFFAOYSA-N |
Molecular Weight |
257.377 g/mol |
SMILES |
C1(C2C(N=C(O1)C1=CC=CC=C1)CCCC2)(CC)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.92851 |