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3-Benzylidene-N-phenyl-4-tosyloctahydro-2H-benzo[b][1,4]thiazin-2-imine
SpectraBase Compound ID FB6t16BldR1
InChI InChI=1S/C28H28N2O2S2/c1-21-16-18-24(19-17-21)34(31,32)30-25-14-8-9-15-27(25)33-28(29-23-12-6-3-7-13-23)26(30)20-22-10-4-2-5-11-22/h2-7,10-13,16-20,25,27H,8-9,14-15H2,1H3
InChIKey FPFQFJSUDLORHY-UHFFFAOYSA-N
Mol Weight 488.66 g/mol
Molecular Formula C28H28N2O2S2
Exact Mass 488.15922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4QFY4kXEQa
Name 3-Benzylidene-N-phenyl-4-tosyloctahydro-2H-benzo[b][1,4]thiazin-2-imine
Appearance Pale yellow powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H28N2O2S2
InChI InChI=1S/C28H28N2O2S2/c1-21-16-18-24(19-17-21)34(31,32)30-25-14-8-9-15-27(25)33-28(29-23-12-6-3-7-13-23)26(30)20-22-10-4-2-5-11-22/h2-7,10-13,16-20,25,27H,8-9,14-15H2,1H3
InChIKey FPFQFJSUDLORHY-UHFFFAOYSA-N
Instrument Name FinniganMAT-8430
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3418
Molecular Weight 488.664 g/mol
SMILES C1(=Nc2ccccc2)C(=Cc2ccccc2)N(S(c2ccc(C)cc2)(=O)=O)C2C(S1)CCCC2
SPLASH splash10-0a6r-6900000000-a0552b146dc082f24e87
Source of Spectrum Y-56-453-4e
Wiley ID 1859387