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5-(4-METHOXYBENZYLIDENE)-3-(PIPERIDINOMETHYL)-2-THIOHYDANTOIN
SpectraBase Compound ID 2aoWRAHQwlY
InChI InChI=1S/C17H21N3O2S/c1-22-14-7-5-13(6-8-14)11-15-16(21)20(17(23)18-15)12-19-9-3-2-4-10-19/h5-8,11H,2-4,9-10,12H2,1H3,(H,18,23)/b15-11-
InChIKey PQQMTSHCNWPQES-PTNGSMBKSA-N
Mol Weight 331.43 g/mol
Molecular Formula C17H21N3O2S
Exact Mass 331.135448 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JSPQBlTDXSV
Name 5-(4-METHOXYBENZYLIDENE)-3-(PIPERIDINOMETHYL)-2-THIOHYDANTOIN
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H21N3O2S
InChI InChI=1S/C17H21N3O2S/c1-22-14-7-5-13(6-8-14)11-15-16(21)20(17(23)18-15)12-19-9-3-2-4-10-19/h5-8,11H,2-4,9-10,12H2,1H3,(H,18,23)/b15-11-
InChIKey PQQMTSHCNWPQES-PTNGSMBKSA-N
Molecular Weight 331.1350
SMILES N1C(N(C(\C1=C/c1ccc(OC)cc1)=O)CN1CCCCC1)=S
SPLASH splash10-0002-9210000000-489272fcdb7f4441a30e
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany