SpectraBase Spectrum ID |
2oof3AIYMUZ |
Name |
L-Methionine, N-isopropyloxycarbonyl-, methyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
249.103479266 u |
Formula |
C10H19NO4S |
InChI |
InChI=1S/C10H19NO4S/c1-7(2)15-10(13)11-8(5-6-16-4)9(12)14-3/h7-8H,5-6H2,1-4H3,(H,11,13) |
InChIKey |
MHPOBPPYYNECJL-UHFFFAOYSA-N |
Molecular Weight |
249.325 g/mol |
SMILES |
CSCCC(C(OC)=O)NC(OC(C)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.926091 |