| SpectraBase Spectrum ID |
GhY9rx75XtP |
| Name |
(S)-1-(p-Methoxyphenyl)-4-exo-phenylthio-1H,4H-furo[3,4-B]aziridin-2-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
313.077264518 u |
| Formula |
C17H15NO3S |
| InChI |
InChI=1S/C17H15NO3S/c1-20-12-9-7-11(8-10-12)18-14-15(18)17(21-16(14)19)22-13-5-3-2-4-6-13/h2-10,14-15,17H,1H3/t14?,15?,17-,18?/m0/s1 |
| InChIKey |
HKBDJZQXXMWTTA-OQJBAJDCSA-N |
| Molecular Weight |
313.371 g/mol |
| SMILES |
C12C([C@@](SC3=CC=CC=C3)([H])OC1=O)N2C=1C=CC(=CC1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.819506 |
![(S)-1-(p-Methoxyphenyl)-4-exo-phenylthio-1H,4H-furo[3,4-b]aziridin-2-one](/api/spectrum/GhY9rx75XtP/structure.png?h=300&w=458 "(S)-1-(p-Methoxyphenyl)-4-exo-phenylthio-1H,4H-furo[3,4-b]aziridin-2-one")
