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3-Methoxycarbonyl-1,4,5,6,7,8-hexahydro-cyclohepta(B)pyrrole-2-carboxylic acid, methyl ester
SpectraBase Compound ID 4d4OLOoNm3X
InChI InChI=1S/C13H17NO4/c1-17-12(15)10-8-6-4-3-5-7-9(8)14-11(10)13(16)18-2/h14H,3-7H2,1-2H3
InChIKey RLDLLNNWBVFSDE-UHFFFAOYSA-N
Mol Weight 251.28 g/mol
Molecular Formula C13H17NO4
Exact Mass 251.115758 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GYksSIJzVQX
Name 3-Methoxycarbonyl-1,4,5,6,7,8-hexahydro-cyclohepta(B)pyrrole-2-carboxylic acid, methyl ester
CAS Registry Number 89649-59-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H17NO4
InChI InChI=1S/C13H17NO4/c1-17-12(15)10-8-6-4-3-5-7-9(8)14-11(10)13(16)18-2/h14H,3-7H2,1-2H3
InChIKey RLDLLNNWBVFSDE-UHFFFAOYSA-N
Instrument Name Jeol FX-90
Literature Reference M.P. Sammes, A.R. Katritzky, K.W.Law, Magn. Res. Chem. 24, 827 (1986).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3