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Thiobenzyl malonate-t-butyl-methyl ester
SpectraBase Compound ID 1WX7rZkdJpb
InChI InChI=1S/C15H20O4S/c1-15(2,3)19-14(17)12(13(16)18-4)20-10-11-8-6-5-7-9-11/h5-9,12H,10H2,1-4H3
InChIKey BEAIGRWOMXCMIS-UHFFFAOYSA-N
Mol Weight 296.38 g/mol
Molecular Formula C15H20O4S
Exact Mass 296.10823 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3NWKH9oIIQV
Name Thiobenzyl malonate-t-butyl-methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O4S
InChI InChI=1S/C15H20O4S/c1-15(2,3)19-14(17)12(13(16)18-4)20-10-11-8-6-5-7-9-11/h5-9,12H,10H2,1-4H3
InChIKey BEAIGRWOMXCMIS-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.19730560406
Molecular Weight 296.381 g/mol
SMILES C(C(OC)=O)(C(OC(C)(C)C)=O)SCc1ccccc1
SPLASH splash10-004i-9000000000-be0427b292012758e903
Source of Spectrum H-56-1221-3
Synonyms 1-(tert-butyl) 3-methyl 2-(benzylthio)malonate
Wiley ID 1797098