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Allyl (Ss)-3-(p-tosylsulfinyl)-1,4-dihydropyridine-1-carboxylate
SpectraBase Compound ID 1h38DG9eu9E
InChI InChI=1S/C16H17NO3S/c1-3-11-20-16(18)17-10-4-5-15(12-17)21(19)14-8-6-13(2)7-9-14/h3-4,6-10,12H,1,5,11H2,2H3
InChIKey ZHFABMGXBMOJGE-UHFFFAOYSA-N
Mol Weight 303.38 g/mol
Molecular Formula C16H17NO3S
Exact Mass 303.092915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GTcEePuh80v
Name Allyl (Ss)-3-(p-tosylsulfinyl)-1,4-dihydropyridine-1-carboxylate
Alternate Name(s) Allyl 3-[(4-methylphenyl)sulfinyl]-1(4H)-pyridinecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17NO3S
InChI InChI=1S/C16H17NO3S/c1-3-11-20-16(18)17-10-4-5-15(12-17)21(19)14-8-6-13(2)7-9-14/h3-4,6-10,12H,1,5,11H2,2H3
InChIKey ZHFABMGXBMOJGE-UHFFFAOYSA-N
Molecular Weight 303.376 g/mol
SMILES C1([S@](c2ccc(cc2)C)=O)=CN(C(=O)OCC=C)C=CC1
SPLASH splash10-000i-1190000000-34d287b4f41012018b8c
Source of Spectrum H1-44-541-1
Wiley ID 758222