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Spiro(bicyclo(2.1.0)pentane-5,1'-cyclopenta-2',4'-diene) N-phenyl-triazolinedione bisadduct

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Spiro(bicyclo(2.1.0)pentane-5,1'-cyclopenta-2',4'-diene) N-phenyl-triazolinedione bisadduct
SpectraBase Compound ID Bte8SVveW9y
InChI InChI=1S/C25H20N6O4/c32-21-26(15-7-3-1-4-8-15)22(33)29-18-12-11-17(28(21)29)25(18)19-13-14-20(25)31-24(35)27(23(34)30(19)31)16-9-5-2-6-10-16/h1-12,17-20H,13-14H2/t17-,18+,19-,20+,25-/m1/s1
InChIKey WMTGIEFMUYXCIS-LAMKJYLKSA-N
Mol Weight 468.47 g/mol
Molecular Formula C25H20N6O4
Exact Mass 468.154603 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CCHlImklLKa
Name Spiro(bicyclo(2.1.0)pentane-5,1'-cyclopenta-2',4'-diene) N-phenyl-triazolinedione bisadduct
CAS Registry Number 89597-58-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C25H20N6O4
InChI InChI=1S/C25H20N6O4/c32-21-26(15-7-3-1-4-8-15)22(33)29-18-12-11-17(28(21)29)25(18)19-13-14-20(25)31-24(35)27(23(34)30(19)31)16-9-5-2-6-10-16/h1-12,17-20H,13-14H2/t17-,18+,19-,20+,25-/m1/s1
InChIKey WMTGIEFMUYXCIS-LAMKJYLKSA-N
Instrument Name Varian XL-200
Literature Reference L. McElweg, D.A. Dougherty, J. Am. Chem. Soc. 106, 3466 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3