| SpectraBase Compound ID | 5Ue7jIQ5byd |
|---|---|
| InChI | InChI=1S/C14H19NO4S/c1-16-11-8-10(9-12(17-2)13(11)18-3)14(20)15-4-6-19-7-5-15/h8-9H,4-7H2,1-3H3 |
| InChIKey | MVOUIYUWRXPNKD-UHFFFAOYSA-N |
| Mol Weight | 297.37 g/mol |
| Molecular Formula | C14H19NO4S |
| Exact Mass | 297.103479 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | L9aJX1Wn2f5 |
|---|---|
| Name | 4-(3,4,5-Trimethoxythiobenzoyl)morpholine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 297.103479266 u |
| Formula | C14H19NO4S |
| InChI | InChI=1S/C14H19NO4S/c1-16-11-8-10(9-12(17-2)13(11)18-3)14(20)15-4-6-19-7-5-15/h8-9H,4-7H2,1-3H3 |
| InChIKey | MVOUIYUWRXPNKD-UHFFFAOYSA-N |
| SMILES | C1(=CC(=C(C(=C1)OC)OC)OC)C(N1CCOCC1)=S |
| Spectrum/Structure Validation Score (Raman) | 0.971331 |