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Annulated semibullvalene

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Annulated semibullvalene
SpectraBase Compound ID 7yk6Y7p6iAn
InChI InChI=1S/C16H16/c1-2-4-13-10-15-8-6-11-5-7-14(16(11)15)9-12(13)3-1/h1-8,11,14-16H,9-10H2
InChIKey BHQLZJOHQRNIMG-UHFFFAOYSA-N
Mol Weight 208.3 g/mol
Molecular Formula C16H16
Exact Mass 208.125201 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GDWDyVKOzpf
Name Annulated semibullvalene
CAS Registry Number 64891-76-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H16
InChI InChI=1S/C16H16/c1-2-4-13-10-15-8-6-11-5-7-14(16(11)15)9-12(13)3-1/h1-8,11,14-16H,9-10H2
InChIKey BHQLZJOHQRNIMG-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference L.A. Paquette, T.G. Wallis, T.Kempe, J. Am. Chem. Soc. 99, 6946 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3