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Perylen-3,9-dicarboxylic acid, diisobutyl ester
SpectraBase Compound ID ErCO98PZTLo
InChI InChI=1S/C30H28O4/c1-17(2)15-33-29(31)25-13-11-23-20-8-6-10-22-26(30(32)34-16-18(3)4)14-12-24(28(20)22)19-7-5-9-21(25)27(19)23/h5-14,17-18H,15-16H2,1-4H3
InChIKey YLNJGHNUXCVDIX-UHFFFAOYSA-N
Mol Weight 452.55 g/mol
Molecular Formula C30H28O4
Exact Mass 452.198759 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dx2gYvf1ZAu
Name Perylen-3,9-dicarboxylic acid, diisobutyl ester
CAS Registry Number 2744-50-5
Comments ZSU-5200-2, VERIFIED BY 2D-NMR (MIXTURE WITH ISOMER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C30H28O4
InChI InChI=1S/C30H28O4/c1-17(2)15-33-29(31)25-13-11-23-20-8-6-10-22-26(30(32)34-16-18(3)4)14-12-24(28(20)22)19-7-5-9-21(25)27(19)23/h5-14,17-18H,15-16H2,1-4H3
InChIKey YLNJGHNUXCVDIX-UHFFFAOYSA-N
Instrument Name Bruker AM-400
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3