| SpectraBase Spectrum ID |
C0T4sVsBJqi |
| Name |
2-(2-Methyl-1-phenyl-1-(phenylsulfonyl)propan-2-yl)oxirane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
316.113315675 u |
| Formula |
C18H20O3S |
| InChI |
InChI=1S/C18H20O3S/c1-18(2,16-13-21-16)17(14-9-5-3-6-10-14)22(19,20)15-11-7-4-8-12-15/h3-12,16-17H,13H2,1-2H3 |
| InChIKey |
QBULGDYDPNITMC-UHFFFAOYSA-N |
| Molecular Weight |
316.415 g/mol |
| SMILES |
C(S(=O)(=O)C=1C=CC=CC1)(C(C1OC1)(C)C)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.810708 |
