SpectraBase Spectrum ID |
76dzz5D7FiJ |
Name |
[2'-(Methoxycarbonyl)ethyl](pivaloyl)carbamodithioate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
263.064985756 u |
Formula |
C10H17NO3S2 |
InChI |
InChI=1S/C10H17NO3S2/c1-10(2,3)8(13)11-9(15)16-6-5-7(12)14-4/h5-6H2,1-4H3,(H,11,13,15) |
InChIKey |
UGUCQZAZCAOURR-UHFFFAOYSA-N |
Molecular Weight |
263.370 g/mol |
SMILES |
C(NC(=S)SCCC(=O)OC)(C(C)(C)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.968946 |