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TRANS-3-BrOMO-2-METHOXY-1-PIPERIDINECARBOXYLIC-ACID-PHENYLESTER
SpectraBase Compound ID 3tEXFpyGi0x
InChI InChI=1S/2C13H16BrNO3/c2*1-17-12-11(14)8-5-9-15(12)13(16)18-10-6-3-2-4-7-10/h2*2-4,6-7,11-12H,5,8-9H2,1H3/t2*11-,12+/m11/s1
InChIKey IDOKTJOLGRQTLC-HERGQZGSSA-N
Mol Weight 628.36 g/mol
Molecular Formula C26H32Br2N2O6
Exact Mass 626.062713 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BQD3FsqVDK0
Name TRANS-3-BrOMO-2-METHOXY-1-PIPERIDINECARBOXYLIC-ACID-PHENYLESTER
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H32Br2N2O6
InChI InChI=1S/2C13H16BrNO3/c2*1-17-12-11(14)8-5-9-15(12)13(16)18-10-6-3-2-4-7-10/h2*2-4,6-7,11-12H,5,8-9H2,1H3/t2*11-,12+/m11/s1
InChIKey IDOKTJOLGRQTLC-HERGQZGSSA-N
Literature Reference Author P.STANETTY,M.D.MIHOVILOVIC,K.MEREITER
Literature Reference Citation MH.CHEM.,128,1061(1997)
Literature Reference DOI 10.1007/BF00806971
Molecular Weight 628.358 g/mol
Solvent CDCl3
Source File Reference UWRK2952