John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=4irMQPQR1du SpectraBase Spectrum ID=1kYQ4lpaEom

(accessed ).
5-(4-CHLOROBENZOYL)-2-ANILINO-4-(1-ANTHRACENYL)-3-METHYL-FORMIATE-THIOPHENE
SpectraBase Compound ID 4irMQPQR1du
InChI InChI=1S/C33H22ClNO3S/c1-38-33(37)29-28(26-13-7-10-23-18-21-8-5-6-9-22(21)19-27(23)26)31(30(36)20-14-16-24(34)17-15-20)39-32(29)35-25-11-3-2-4-12-25/h2-19,35H,1H3
InChIKey IXHAIMYEWLOKST-UHFFFAOYSA-N
Mol Weight 548.1 g/mol
Molecular Formula C33H22ClNO3S
Exact Mass 547.100893 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1kYQ4lpaEom
Name 5-(4-CHLOROBENZOYL)-2-ANILINO-4-(1-ANTHRACENYL)-3-METHYL-FORMIATE-THIOPHENE
Compound Number 5B
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H22ClNO3S
InChI InChI=1S/C33H22ClNO3S/c1-38-33(37)29-28(26-13-7-10-23-18-21-8-5-6-9-22(21)19-27(23)26)31(30(36)20-14-16-24(34)17-15-20)39-32(29)35-25-11-3-2-4-12-25/h2-19,35H,1H3
InChIKey IXHAIMYEWLOKST-UHFFFAOYSA-N
Literature Reference Author A.KNIESZ,M.GRUNER,R.MAYER
Literature Reference Citation MH.CHEM.,127,1173(1996)
Literature Reference DOI 10.1007/BF00844693
Molecular Weight 548.056 g/mol
Solvent CDCl3
Source File Reference UWMZ187
SpectraBase Batch ID D1msh4ZHevq