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2,3,3a,12a-Tetrahydro-1H-cyclopenta[c]pyrene

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2,3,3a,12a-Tetrahydro-1H-cyclopenta[c]pyrene
SpectraBase Compound ID BIdma1Xsvx0
InChI InChI=1S/C19H16/c1-3-13-6-7-15-8-9-16-5-2-11-19(16)12-10-14(4-1)17(13)18(15)19/h1,3-4,6-10,12,16H,2,5,11H2/t16-,19+/m0/s1
InChIKey AIYJOJIJQKBDOM-QFBILLFUSA-N
Mol Weight 244.34 g/mol
Molecular Formula C19H16
Exact Mass 244.125201 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KQXhzbbCmwy
Name 2,3,3A,12A-TETRAHYDRO-1H-CYCLOPENTA-[C]-PYRENE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H16
InChI InChI=1S/C19H16/c1-3-13-6-7-15-8-9-16-5-2-11-19(16)12-10-14(4-1)17(13)18(15)19/h1,3-4,6-10,12,16H,2,5,11H2/t16-,19+/m0/s1
InChIKey AIYJOJIJQKBDOM-QFBILLFUSA-N
Literature Reference Author J.T.M.VANDIJK,J.LUGTENBERG,J.CORNELISSE
Literature Reference Citation J.CHEM.SOC.PERKIN-2,1489(1995)
Literature Reference DOI 10.1039/p29950001489
Molecular Weight 244.336 g/mol
Solvent CDCl3
Source File Reference WANG318