SpectraBase Spectrum ID |
CJaHGnq2JsA |
Name |
3-Benzyl-4-methyl-3,4-dihydro-1,3-benzo[E]-(1,3)-oxazin-2-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
253.110278725 u |
Formula |
C16H15NO2 |
InChI |
InChI=1S/C16H15NO2/c1-12-14-9-5-6-10-15(14)19-16(18)17(12)11-13-7-3-2-4-8-13/h2-10,12H,11H2,1H3 |
InChIKey |
WWAQAXUWJVVUBH-UHFFFAOYSA-N |
Molecular Weight |
253.301 g/mol |
SMILES |
C1(N(C(C2=C(O1)C=CC=C2)C)CC1=CC=CC=C1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.939757 |