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(1'E,3'E,5'E,7'E)-AUXARCONJUGATIN-A;(1'E,3'E,5'E,7'E)-6-(8-(3-CHLORO-1H-PYRROL-2-YL)-1,3,5,7-OCTATETRAENYL)-4-METHOXY-3-METHYL-2H-PYRAN-2-ONE

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(1'E,3'E,5'E,7'E)-AUXARCONJUGATIN-A;(1'E,3'E,5'E,7'E)-6-(8-(3-CHLORO-1H-PYRROL-2-YL)-1,3,5,7-OCTATETRAENYL)-4-METHOXY-3-METHYL-2H-PYRAN-2-ONE
SpectraBase Compound ID BgiSbMKcmd4
InChI InChI=1S/C19H18ClNO3/c1-14-18(23-2)13-15(24-19(14)22)9-7-5-3-4-6-8-10-17-16(20)11-12-21-17/h3-13,21H,1-2H3/b5-3+,6-4+,9-7+,10-8+
InChIKey PVDBICYNLATHGO-MIIZMDLZSA-N
Mol Weight 343.81 g/mol
Molecular Formula C19H18ClNO3
Exact Mass 343.097521 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AJjelkZeLLd
Name (1'E,3'E,5'E,7'E)-AUXARCONJUGATIN-A;(1'E,3'E,5'E,7'E)-6-(8-(3-CHLORO-1H-PYRROL-2-YL)-1,3,5,7-OCTATETRAENYL)-4-METHOXY-3-METHYL-2H-PYRAN-2-ONE
Compound Number 1A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H18ClNO3
InChI InChI=1S/C19H18ClNO3/c1-14-18(23-2)13-15(24-19(14)22)9-7-5-3-4-6-8-10-17-16(20)11-12-21-17/h3-13,21H,1-2H3/b5-3+,6-4+,9-7+,10-8+
InChIKey PVDBICYNLATHGO-MIIZMDLZSA-N
Literature Reference Author T.HOSOE,K.FUKUSHIMA,K.TAKIZAWA,M.MIYAJI,K.I.KAWAI
Literature Reference Citation PHYTOCHEM.,52,459(1999)
Literature Reference DOI 10.1016/S0031-9422(99)00237-X
Molecular Weight 343.810 g/mol
Solvent DMSO-D6
Source File Reference UWVN584