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(1a,2b,3a,6a,7b,8a,9a,14A)-4,5-Benzo-pentacyclo(6.6.1.1/3,6/.0/2,7/.0/9,14/)hexadeca-4,10,12-triene
SpectraBase Compound ID F7YH2ZmsoLF
InChI InChI=1S/C20H20/c1-2-6-12-11(5-1)15-9-16(12)20-18-10-17(19(15)20)13-7-3-4-8-14(13)18/h1-8,11-12,15-20H,9-10H2/t11-,12+,15-,16+,17-,18-,19-,20+/m1/s1
InChIKey YIHTXSLLHKOUDL-KRWITKOXSA-N
Mol Weight 260.38 g/mol
Molecular Formula C20H20
Exact Mass 260.156501 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ciBxtCS5gA
Name (1a,2b,3a,6a,7b,8a,9a,14A)-4,5-Benzo-pentacyclo(6.6.1.1/3,6/.0/2,7/.0/9,14/)hexadeca-4,10,12-triene
CAS Registry Number 65879-05-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H20
InChI InChI=1S/C20H20/c1-2-6-12-11(5-1)15-9-16(12)20-18-10-17(19(15)20)13-7-3-4-8-14(13)18/h1-8,11-12,15-20H,9-10H2/t11-,12+,15-,16+,17-,18-,19-,20+/m1/s1
InChIKey YIHTXSLLHKOUDL-KRWITKOXSA-N
Literature Reference W.D. Fessner, G. Sedelmeier, P.R.Spurr, J. Am. Chem. Soc. 109, 4627 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported