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2,4-Bis(4-butyl-anilino)-5,6-dimethyl-7H-pyrrolo(2,3-D)pyrimidine
SpectraBase Compound ID A6UnXX6l7Ay
InChI InChI=1S/C28H35N5/c1-5-7-9-21-11-15-23(16-12-21)30-27-25-19(3)20(4)29-26(25)32-28(33-27)31-24-17-13-22(14-18-24)10-8-6-2/h11-18H,5-10H2,1-4H3,(H3,29,30,31,32,33)
InChIKey UQNJAVSJJUZDNA-UHFFFAOYSA-N
Mol Weight 441.6 g/mol
Molecular Formula C28H35N5
Exact Mass 441.289246 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Akp9HfKLJrd
Name 2,4-Bis(4-butyl-anilino)-5,6-dimethyl-7H-pyrrolo(2,3-D)pyrimidine
CAS Registry Number 116673-08-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C28H35N5
InChI InChI=1S/C28H35N5/c1-5-7-9-21-11-15-23(16-12-21)30-27-25-19(3)20(4)29-26(25)32-28(33-27)31-24-17-13-22(14-18-24)10-8-6-2/h11-18H,5-10H2,1-4H3,(H3,29,30,31,32,33)
InChIKey UQNJAVSJJUZDNA-UHFFFAOYSA-N
Instrument Name Jeol FX-90
Literature Reference A. Jorgensen, H.H. Moharram, E.B. Pedersen, Chemica Scripta 28, 201 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6