SpectraBase Spectrum ID |
LfvG9v6Aqpj |
Name |
L-Cysteine, N,S-bis(N-propyloxycarbonyl)-, N-propyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
335.140258697 u |
Formula |
C14H25NO6S |
InChI |
InChI=1S/C14H25NO6S/c1-4-7-19-12(16)11(15-13(17)20-8-5-2)10-22-14(18)21-9-6-3/h11H,4-10H2,1-3H3,(H,15,17) |
InChIKey |
LRDHZWJQGPYKOQ-UHFFFAOYSA-N |
Molecular Weight |
335.415 g/mol |
SMILES |
C(C(CSC(OCCC)=O)NC(OCCC)=O)(OCCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.945152 |