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1-(4-(5-Hydroxy-1-tosyl-1,2,5,6-tetrahydropyridin-3-yl)phenyl)ethan-1-one
SpectraBase Compound ID LQxKlqCnczC
InChI InChI=1S/C20H21NO4S/c1-14-3-9-20(10-4-14)26(24,25)21-12-18(11-19(23)13-21)17-7-5-16(6-8-17)15(2)22/h3-11,19,23H,12-13H2,1-2H3
InChIKey JXZWWSQCRBTEMQ-UHFFFAOYSA-N
Mol Weight 371.45 g/mol
Molecular Formula C20H21NO4S
Exact Mass 371.119129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 32glTDHRtKi
Name 1-(4-(5-Hydroxy-1-tosyl-1,2,5,6-tetrahydropyridin-3-yl)phenyl)ethan-1-one
Appearance Pale yellow oil
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Exact Mass 371.119129330 u
Formula C20H21NO4S
InChI InChI=1S/C20H21NO4S/c1-14-3-9-20(10-4-14)26(24,25)21-12-18(11-19(23)13-21)17-7-5-16(6-8-17)15(2)22/h3-11,19,23H,12-13H2,1-2H3
InChIKey JXZWWSQCRBTEMQ-UHFFFAOYSA-N
Instrument Name LRMS
Ionization Type EI
Literature Reference DOI 10.1002/chem.202203068
Molecular Weight 371.451 g/mol
Reported Formula C20H21NO4S
SMILES OC1C=C(CN(C1)S(C1=CC=C(C=C1)C)(=O)=O)C1=CC=C(C=C1)C(=O)C
SPLASH splash10-001a-0901000000-fc3de55fa5337c12f8ec
Source of Spectrum QE-29-SM26-3ai (DOI: 10.1002/chem.202203068)
Thin-Layer Chromatography 0.40 (50% EtOAc/hexane)
Wiley ID 1909448