SpectraBase Spectrum ID |
IP9as0wo9Lw |
Name |
(4S)-4-Isopropyl-2-phenyl-4,5-dihydro-1,3-oxazole |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
189.115364106 u |
Formula |
C12H15NO |
InChI |
InChI=1S/C12H15NO/c1-9(2)11-8-14-12(13-11)10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3/t11-/m1/s1 |
InChIKey |
QPADYYUBHQRRIR-LLVKDONJSA-N |
Molecular Weight |
189.258 g/mol |
SMILES |
C1(=N[C@](CO1)(C(C)C)[H])C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.912488 |