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(Z)-4-(2-CHLOROETHYLIDENE)-2-METHOXY-3-(4-NITRO)-BENZYLOXY-DELTA(ALPHA,BETA)-BUTENOLIDE
SpectraBase Compound ID 1kfy7u4SEbu
InChI InChI=1S/C14H12ClNO6/c1-20-13-12(11(6-7-15)22-14(13)17)21-8-9-2-4-10(5-3-9)16(18)19/h2-6H,7-8H2,1H3/b11-6-
InChIKey REZWXYVFRATVPK-WDZFZDKYSA-N
Mol Weight 325.7 g/mol
Molecular Formula C14H12ClNO6
Exact Mass 325.035315 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KQzRQaCPjol
Name (Z)-4-(2-CHLOROETHYLIDENE)-2-METHOXY-3-(4-NITRO)-BENZYLOXY-DELTA(ALPHA,BETA)-BUTENOLIDE
Compound Number 2B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H12ClNO6
InChI InChI=1S/C14H12ClNO6/c1-20-13-12(11(6-7-15)22-14(13)17)21-8-9-2-4-10(5-3-9)16(18)19/h2-6H,7-8H2,1H3/b11-6-
InChIKey REZWXYVFRATVPK-WDZFZDKYSA-N
Literature Reference Author G.H.HAKIMELAHI,N.W.MEI,A.A.MOOSAVI-MOVAHEDI,H.DAVARI,S.HAKIM ELAHI,K.Y.KING,J.R.H
Literature Reference Citation J.MED.CHEM.,44,1749(2001)
Literature Reference DOI 10.1021/jm0004446
Molecular Weight 325.705 g/mol
Sample ID 44514
Solvent CDCl3