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1-(Indol-3-yl-methyl)-3-(2-tolyl)-hydantoin
SpectraBase Compound ID LDgC5lA0AXt
InChI InChI=1S/C19H17N3O2/c1-13-6-2-5-9-17(13)22-18(23)12-21(19(22)24)11-14-10-20-16-8-4-3-7-15(14)16/h2-10,20H,11-12H2,1H3
InChIKey CGZBALFRLCCJME-UHFFFAOYSA-N
Mol Weight 319.36 g/mol
Molecular Formula C19H17N3O2
Exact Mass 319.132077 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7sx80ahWHtZ
Name 1-(Indol-3-yl-methyl)-3-(2-tolyl)-hydantoin
Comments ROTAMER 1 (LOWER PPM VALUES) REASSIGNED (A.H.)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C19H17N3O2
InChI InChI=1S/C19H17N3O2/c1-13-6-2-5-9-17(13)22-18(23)12-21(19(22)24)11-14-10-20-16-8-4-3-7-15(14)16/h2-10,20H,11-12H2,1H3
InChIKey CGZBALFRLCCJME-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference H. Fujiwara, A.K. Bose, M.S. Manhas, J. Chem. Soc. Perkin II 1573 (1980).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3