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Elymoclavine acetate
SpectraBase Compound ID 2DXwSIsdK6Y
InChI InChI=1S/C18H20N2O2/c1-11(21)22-10-12-6-15-14-4-3-5-16-18(14)13(8-19-16)7-17(15)20(2)9-12/h3-6,8,15,17,19H,7,9-10H2,1-2H3/t15-,17-/m1/s1
InChIKey MXXXXLYPPRGOGK-NVXWUHKLSA-N
Mol Weight 296.37 g/mol
Molecular Formula C18H20N2O2
Exact Mass 296.152478 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 58yEWT5yN4f
Name ELYMOCLAVINE-ACETATE
CAS Registry Number 5080-45-5
Compound Number 1C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H20N2O2
InChI InChI=1S/C18H20N2O2/c1-11(21)22-10-12-6-15-14-4-3-5-16-18(14)13(8-19-16)7-17(15)20(2)9-12/h3-6,8,15,17,19H,7,9-10H2,1-2H3/t15-,17-/m1/s1
InChIKey MXXXXLYPPRGOGK-NVXWUHKLSA-N
Literature Reference Author N.J.BACH,H.E.BOAZ,E.C.KORNFELD,C.J.CHANG,H.G.FLOSS,E.W.HAGAM AN,E.WENKERT
Literature Reference Citation J.ORG.CHEM.,39,1272(1974)
Literature Reference DOI 10.1021/jo00923a025
Molecular Weight 296.369 g/mol
Solvent CDCl3
Source File Reference UNIW12079