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Pyrene
SpectraBase Compound ID JSV5py4Jyyt
InChI InChI=1S/C16H10/c1-3-11-7-9-13-5-2-6-14-10-8-12(4-1)15(11)16(13)14/h1-10H
InChIKey BBEAQIROQSPTKN-UHFFFAOYSA-N
Mol Weight 202.26 g/mol
Molecular Formula C16H10
Exact Mass 202.07825 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hc18x7krY1w
Name Pyrene
CAS Registry Number 129-00-0
Comments C1 IS C-13 LABELLED J(C,H) FROM ORG.MAGN.RESONANCE 12,109(1979) P.E.HANSEN,O.K.POULSEN,A.BERG,ORG.MAGN.RESO
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Formula C16H10
InChI InChI=1S/C16H10/c1-3-11-7-9-13-5-2-6-14-10-8-12(4-1)15(11)16(13)14/h1-10H
InChIKey BBEAQIROQSPTKN-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference P.E. Hansen, O.K. Poulsen, Org. Magn. Resonance 7, 475 (1975).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CS2