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4,5:10,11-Dibenzo-pentacyclo(6.4.0.0/2,7/.0/3,12/.0/6,9/)dodeca-4,10-diene

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4,5:10,11-Dibenzo-pentacyclo(6.4.0.0/2,7/.0/3,12/.0/6,9/)dodeca-4,10-diene
SpectraBase Compound ID CncNDlE1q1W
InChI InChI=1S/C20H16/c1-2-6-10-9(5-1)13-15-11-7-3-4-8-12(11)16-14(10)18-17(13)19(15)20(16)18/h1-8,13-20H/t13-,14-,15-,16+,17-,18+,19-,20+/m1/s1
InChIKey PBLBVJYMDTYSQP-BBXJSABNSA-N
Mol Weight 256.35 g/mol
Molecular Formula C20H16
Exact Mass 256.125201 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FjVzNbjuB0y
Name 4,5:10,11-Dibenzo-pentacyclo(6.4.0.0/2,7/.0/3,12/.0/6,9/)dodeca-4,10-diene
CAS Registry Number 80052-75-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H16
InChI InChI=1S/C20H16/c1-2-6-10-9(5-1)13-15-11-7-3-4-8-12(11)16-14(10)18-17(13)19(15)20(16)18/h1-8,13-20H/t13-,14-,15-,16+,17-,18+,19-,20+/m1/s1
InChIKey PBLBVJYMDTYSQP-BBXJSABNSA-N
Literature Reference Y. Tobe, F. Hirata, K. Nishida, J. Chem. Soc. Chem. Comm. 786 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3