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(1S,2S)-2-(1-METHOXYCARBONYLETHYLAMINO)-4-OXO-4-PHENYL-BUTYRIC-ACID-ETHYLESTER-HYDROCHLORIDE
SpectraBase Compound ID 2X4joNQTFNv
InChI InChI=1S/C16H21NO5.ClH/c1-4-22-16(20)13(17-11(2)15(19)21-3)10-14(18)12-8-6-5-7-9-12;/h5-9,11,13,17H,4,10H2,1-3H3;1H/t11-,13-;/m0./s1
InChIKey JMTHMVBMXUNJIP-JZKFLRDJSA-N
Mol Weight 343.81 g/mol
Molecular Formula C16H22ClNO5
Exact Mass 343.118651 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HLDc8vZ9PTR
Name (1S,2S)-2-(1-METHOXYCARBONYLETHYLAMINO)-4-OXO-4-PHENYL-BUTYRIC-ACID-ETHYLESTER-HYDROCHLORIDE
Compound Number 4B* HCL
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H22ClNO5
InChI InChI=1S/C16H21NO5.ClH/c1-4-22-16(20)13(17-11(2)15(19)21-3)10-14(18)12-8-6-5-7-9-12;/h5-9,11,13,17H,4,10H2,1-3H3;1H/t11-,13-;/m0./s1
InChIKey JMTHMVBMXUNJIP-JZKFLRDJSA-N
Literature Reference Author M.KNOLLMUELLER,M.FERENCIC,P.GAERTNER,U.GIRRESER,M.KLINGE,L.G AISCHIN,K.MEREITER,C
Literature Reference Citation MH.CHEM.,130,769(1999)
Literature Reference DOI 10.1007/s007060050238
Molecular Weight 343.807 g/mol
Solvent CDCl3
Source File Reference UWCS25407