| SpectraBase Spectrum ID |
2HVxJuAIryG |
| Name |
Dimethyl 4-tert-butyl-2-phenyl-4H-1,3-thiazine-5,6-dicarboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
347.119129330 u |
| Formula |
C18H21NO4S |
| InChI |
InChI=1S/C18H21NO4S/c1-18(2,3)14-12(16(20)22-4)13(17(21)23-5)24-15(19-14)11-9-7-6-8-10-11/h6-10,14H,1-5H3 |
| InChIKey |
JCPWHSUHWYZWSR-UHFFFAOYSA-N |
| Molecular Weight |
347.429 g/mol |
| SMILES |
C=1(SC(=C(C(N1)C(C)(C)C)C(=O)OC)C(=O)OC)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.835496 |
