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3,4-dihydrothio-2(1H)-isoquinolinecarboxy-2',6 '-xylidide

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 UV-Vis

3,4-dihydrothio-2(1H)-isoquinolinecarboxy-2',6 '-xylidide
SpectraBase Compound ID 7OvKMLcYWzT
InChI InChI=1S/C18H20N2S/c1-13-6-5-7-14(2)17(13)19-18(21)20-11-10-15-8-3-4-9-16(15)12-20/h3-9H,10-12H2,1-2H3,(H,19,21)
InChIKey PAECKTGKFHEITB-UHFFFAOYSA-N
Mol Weight 296.43 g/mol
Molecular Formula C18H20N2S
Exact Mass 296.13472 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2CUaytnsgbf
Name 3,4-DIHYDROTHIO-2(1H)-ISOQUINOLINECARBOXY-2',6'-XYLIDIDE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20N2S
InChI InChI=1S/C18H20N2S/c1-13-6-5-7-14(2)17(13)19-18(21)20-11-10-15-8-3-4-9-16(15)12-20/h3-9H,10-12H2,1-2H3,(H,19,21)
InChIKey PAECKTGKFHEITB-UHFFFAOYSA-N
Melting Point 189C
Molecular Weight 296.44
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms ISOQUINOLINECARBOXY-2',6'-XYLIDIDE, 2/1H/-, 3,4-DIHYDROTHIO-,