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4-amino-3-[3-hydroxy-3-(methoxymethyl)-6,7-dimethyl-oct-6-en-1-ynyl]benzoic acid methyl ester
SpectraBase Compound ID 2P8cAAKh90D
InChI InChI=1S/C20H27NO4/c1-14(2)15(3)8-10-20(23,13-24-4)11-9-16-12-17(19(22)25-5)6-7-18(16)21/h6-7,12,23H,8,10,13,21H2,1-5H3
InChIKey UDSNFTZODWPDLT-UHFFFAOYSA-N
Mol Weight 345.44 g/mol
Molecular Formula C20H27NO4
Exact Mass 345.194008 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7SEzf4cjsCW
Name 4-amino-3-[3-hydroxy-3-(methoxymethyl)-6,7-dimethyl-oct-6-en-1-ynyl]benzoic acid methyl ester
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H27NO4
InChI InChI=1S/C20H27NO4/c1-14(2)15(3)8-10-20(23,13-24-4)11-9-16-12-17(19(22)25-5)6-7-18(16)21/h6-7,12,23H,8,10,13,21H2,1-5H3
InChIKey UDSNFTZODWPDLT-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2007)
Molecular Weight 345.439 g/mol
Source File Reference MHKO11787