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YZZDFZVDPCNACW-JLIPXXAWSA-N

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YZZDFZVDPCNACW-JLIPXXAWSA-N
SpectraBase Compound ID A0Wewp28GCy
InChI InChI=1S/C21H20N2O3.ClH/c1-12(24)26-11-13-6-7-14-10-17(13)21(25)20-19-16(8-9-23(14)20)15-4-2-3-5-18(15)22-19;/h2-5,8-9,13-14,17H,6-7,10-11H2,1H3;1H/t13-,14-,17-;/m1./s1
InChIKey YZZDFZVDPCNACW-JLIPXXAWSA-N
Mol Weight 384.86 g/mol
Molecular Formula C21H21ClN2O3
Exact Mass 384.12407 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2SiUpgGORBH
Name YZZDFZVDPCNACW-JLIPXXAWSA-N
Compound Number 29
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H21ClN2O3
InChI InChI=1S/C21H20N2O3.ClH/c1-12(24)26-11-13-6-7-14-10-17(13)21(25)20-19-16(8-9-23(14)20)15-4-2-3-5-18(15)22-19;/h2-5,8-9,13-14,17H,6-7,10-11H2,1H3;1H/t13-,14-,17-;/m1./s1
InChIKey YZZDFZVDPCNACW-JLIPXXAWSA-N
Literature Reference Author J.QUIRANTE,C.ESCOLANO,A.MERINO,J.BONJOCH
Literature Reference Citation J.ORG.CHEM.,63,968(1998)
Literature Reference DOI 10.1021/jo971148c
Molecular Weight 384.862 g/mol
Sample ID 31241
Solvent CD3OD