| SpectraBase Spectrum ID |
7zCqfARA3h2 |
| Name |
(4S,5S)-2-[(Z)-1-Chloranyl-2-phenyl-ethenyl]-4-(methoxymethyl)-5-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 |
327.102606522 u |
| Formula |
C19H18ClNO2 |
| InChI |
InChI=1S/C19H18ClNO2/c1-22-13-17-18(15-10-6-3-7-11-15)23-19(21-17)16(20)12-14-8-4-2-5-9-14/h2-12,17-18H,13H2,1H3/b16-12-/t17-,18-/m0/s1 |
| InChIKey |
CHRFAULHWCRCLL-KZLRIVJYSA-N |
| Molecular Weight |
327.811 g/mol |
| SMILES |
C1(=N[C@@](COC)([C@@](O1)(C1=CC=CC=C1)[H])[H])\C(=C\C1=CC=CC=C1)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.825041 |
![(4S,5S)-2-[(Z)-1-chloranyl-2-phenyl-ethenyl]-4-(methoxymethyl)-5-phenyl-4,5-dihydro-1,3-oxazole](/api/spectrum/7zCqfARA3h2/structure.png?h=300&w=458 "(4S,5S)-2-[(Z)-1-chloranyl-2-phenyl-ethenyl]-4-(methoxymethyl)-5-phenyl-4,5-dihydro-1,3-oxazole")
