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(BUTYLAMMONIUM)-5-(BUTYLAMINO)-4-(METHOXYCARBONYL)-PENTA-2,4-DIENOATE;[1-(BUTYLAMMONIUM)-5-METHYL]-4-[(BUTYLAMINO)-METHYLIDEN]-PENT-2-ENDIOATE
SpectraBase Compound ID IQ1ARhk5Vp5
InChI InChI=1S/C11H17NO4.C4H11N/c1-3-4-7-12-8-9(11(15)16-2)5-6-10(13)14;1-2-3-4-5/h5-6,8,12H,3-4,7H2,1-2H3,(H,13,14);2-5H2,1H3/b6-5+,9-8-;
InChIKey PRZYYTDEFUPPJC-OFYGVIAGSA-N
Mol Weight 300.4 g/mol
Molecular Formula C15H28N2O4
Exact Mass 300.204907 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID WmJlHUUFBY
Name (BUTYLAMMONIUM)-5-(BUTYLAMINO)-4-(METHOXYCARBONYL)-PENTA-2,4-DIENOATE;[1-(BUTYLAMMONIUM)-5-METHYL]-4-[(BUTYLAMINO)-METHYLIDEN]-PENT-2-ENDIOATE
Compound Number 4D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H28N2O4
InChI InChI=1S/C11H17NO4.C4H11N/c1-3-4-7-12-8-9(11(15)16-2)5-6-10(13)14;1-2-3-4-5/h5-6,8,12H,3-4,7H2,1-2H3,(H,13,14);2-5H2,1H3/b6-5+,9-8-;
InChIKey PRZYYTDEFUPPJC-OFYGVIAGSA-N
Literature Reference Author V.KVITA,H.SAUTER,G.RIHS
Literature Reference Citation HELV.CHIM.ACTA,74,407(1991)
Literature Reference DOI 10.1002/hlca.19910740218
Molecular Weight 300.398 g/mol
Solvent DMSO-D6
Source File Reference UWVP5742