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4-Ethyl-4'-(2-methoxycarbonylethyl)-3,3'-dime-5-oxo-2,4-dihydro-2,2'-pyrromethene-5-carboxylic acid, tert-butyl ester
SpectraBase Compound ID 5gVoA9PIFF5
InChI InChI=1S/C22H30N2O5/c1-8-14-12(2)17(24-20(14)26)11-16-13(3)15(9-10-18(25)28-7)19(23-16)21(27)29-22(4,5)6/h11,23H,8-10H2,1-7H3,(H,24,26)/b17-11-
InChIKey ZUMBXICVFLXJMU-BOPFTXTBSA-N
Mol Weight 402.49 g/mol
Molecular Formula C22H30N2O5
Exact Mass 402.215472 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4qrs2YXJL7Q
Name 4-Ethyl-4'-(2-methoxycarbonylethyl)-3,3'-dime-5-oxo-2,4-dihydro-2,2'-pyrromethene-5-carboxylic acid, tert-butyl ester
CAS Registry Number 77611-80-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C22H30N2O5
InChI InChI=1S/C22H30N2O5/c1-8-14-12(2)17(24-20(14)26)11-16-13(3)15(9-10-18(25)28-7)19(23-16)21(27)29-22(4,5)6/h11,23H,8-10H2,1-7H3,(H,24,26)/b17-11-
InChIKey ZUMBXICVFLXJMU-BOPFTXTBSA-N
Instrument Name Varian XL-100
Literature Reference V. Wray, A. Grossauer, B. Gruening, J. Chem. Soc. Perkin II 1558 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CD2Cl2