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6-(2,4-Dioxo-2,3,4,6,7,8,9,10,11,12-decahydro-cycloocta[5,6]pyrido[2,3-D]pyrimidin-12-yl)-hexanoic acid
SpectraBase Compound ID 4nXCgdzZIjl
InChI InChI=1S/C19H25N3O4/c23-16(24)10-6-3-7-11-22-15-9-5-2-1-4-8-13(15)12-14-17(22)20-19(26)21-18(14)25/h12H,1-11H2,(H,23,24)(H,21,25,26)
InChIKey RZUSHVALMVYAAD-UHFFFAOYSA-N
Mol Weight 359.43 g/mol
Molecular Formula C19H25N3O4
Exact Mass 359.184506 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DYDhrsTmkZD
Name 6-(2,4-Dioxo-2,3,4,6,7,8,9,10,11,12-decahydro-cycloocta[5,6]pyrido[2,3-D]pyrimidin-12-yl)-hexanoic acid
CAS Registry Number 53983-60-1
Comments C13-SHIFTS OF THE ALICYCL. RING 36.45-8.50 PPM
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C19H25N3O4
InChI InChI=1S/C19H25N3O4/c23-16(24)10-6-3-7-11-22-15-9-5-2-1-4-8-13(15)12-14-17(22)20-19(26)21-18(14)25/h12H,1-11H2,(H,23,24)(H,21,25,26)
InChIKey RZUSHVALMVYAAD-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference E. Stark, E. Breitmaier, Chem. Ber. 107, 2537 (1974).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6