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6-Benzyl-3,3-dimethyl-5-thioxomorpholin-2-one
SpectraBase Compound ID 58WwN1GlfDD
InChI InChI=1S/C13H15NO2S/c1-13(2)12(15)16-10(11(17)14-13)8-9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3,(H,14,17)
InChIKey AOORTOWDCZWXPP-UHFFFAOYSA-N
Mol Weight 249.33 g/mol
Molecular Formula C13H15NO2S
Exact Mass 249.08235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4G1kXGrJvqE
Name 6-Benzyl-3,3-dimethyl-5-thioxomorpholin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO2S
InChI InChI=1S/C13H15NO2S/c1-13(2)12(15)16-10(11(17)14-13)8-9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3,(H,14,17)
InChIKey AOORTOWDCZWXPP-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.201000318
Molecular Weight 249.328 g/mol
SMILES N1C(C(OC(C1(C)C)=O)Cc1ccccc1)=S
SPLASH splash10-0002-3390000000-7b49e74027a6b61737f4
Source of Spectrum H-93-2339-10b
Wiley ID 1783938