| SpectraBase Spectrum ID |
GOm86cadMPP |
| Name |
1-[2-(4-Methoxyphenyl)-6-methyl-2,3-dihydro-1,4-oxathiin-5-yl]ethanone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
264.082015546 u |
| Formula |
C14H16O3S |
| InChI |
InChI=1S/C14H16O3S/c1-9(15)14-10(2)17-13(8-18-14)11-4-6-12(16-3)7-5-11/h4-7,13H,8H2,1-3H3 |
| InChIKey |
BXEJKKKCGNXUNT-UHFFFAOYSA-N |
| Molecular Weight |
264.339 g/mol |
| SMILES |
C1(=C(OC(CS1)C1=CC=C(C=C1)OC)C)C(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.928238 |
![1-[2-(4-Methoxyphenyl)-6-methyl-2,3-dihydro-1,4-oxathiin-5-yl]ethanone](/api/spectrum/GOm86cadMPP/structure.png?h=300&w=458 "1-[2-(4-Methoxyphenyl)-6-methyl-2,3-dihydro-1,4-oxathiin-5-yl]ethanone")
