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Trifoliaphane

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Trifoliaphane
SpectraBase Compound ID 7aHXNdn2Xn4
InChI InChI=1S/C48H36/c1-2-32-9-21-38(22-10-32)44-43(37-19-7-31(1)8-20-37)45-39-23-11-33(12-24-39)3-4-35-15-27-41(28-16-35)47(45)48-42-29-17-36(18-30-42)6-5-34-13-25-40(26-14-34)46(44)48/h7-30H,1-6H2
InChIKey CXOWLJAVQHOMNA-UHFFFAOYSA-N
Mol Weight 612.8 g/mol
Molecular Formula C48H36
Exact Mass 612.281701 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3GpZg6V4CK0
Name Trifoliaphane
CAS Registry Number 82444-98-2
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C48H36
InChI InChI=1S/C48H36/c1-2-32-9-21-38(22-10-32)44-43(37-19-7-31(1)8-20-37)45-39-23-11-33(12-24-39)3-4-35-15-27-41(28-16-35)47(45)48-42-29-17-36(18-30-42)6-5-34-13-25-40(26-14-34)46(44)48/h7-30H,1-6H2
InChIKey CXOWLJAVQHOMNA-UHFFFAOYSA-N
Literature Reference M. Psiorz, H. Hopf, Angew. Chem. 94, 639 (1982).
NMR Standard CDCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3