| SpectraBase Spectrum ID |
HiL9XGCCilj |
| Name |
(S)-4-((S)-Allyloxy-phenyl-methyl)-2-methyl-4,5-dihydro-oxazole |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
231.125928789 u |
| Formula |
C14H17NO2 |
| InChI |
InChI=1S/C14H17NO2/c1-3-9-16-14(12-7-5-4-6-8-12)13-10-17-11(2)15-13/h3-8,13-14H,1,9-10H2,2H3/t13-,14-/m0/s1 |
| InChIKey |
SMURUDSUYCPCIU-KBPBESRZSA-N |
| Molecular Weight |
231.295 g/mol |
| SMILES |
[C@]1(N=C(OC1)C)([C@](C1=CC=CC=C1)(OCC=C)[H])[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.919632 |
