SpectraBase Spectrum ID |
DSAdGecXXe9 |
Name |
(4S)-4-Methyl-2-(2-pyridinyl)-4,5-dihydrooxazole |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
162.079312949 u |
Formula |
C9H10N2O |
InChI |
InChI=1S/C9H10N2O/c1-7-6-12-9(11-7)8-4-2-3-5-10-8/h2-5,7H,6H2,1H3/t7-/m0/s1 |
InChIKey |
GNRGLELRZLUULL-ZETCQYMHSA-N |
Molecular Weight |
162.192 g/mol |
SMILES |
C1(=N[C@@](C)(CO1)[H])C1=NC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.930054 |