| SpectraBase Spectrum ID |
77AadU7JwOJ |
| Name |
T-Butyl 5-methyl-2-methylimino-1,3-oxathiole-4-carboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
229.077264518 u |
| Formula |
C10H15NO3S |
| InChI |
InChI=1S/C10H15NO3S/c1-6-7(15-9(11-5)13-6)8(12)14-10(2,3)4/h1-5H3/b11-9+ |
| InChIKey |
LKGASCRVUWHAIB-PKNBQFBNSA-N |
| Molecular Weight |
229.294 g/mol |
| SMILES |
C=1(S\C(OC1C)=N/C)C(=O)OC(C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.972042 |
