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Acetylamino-dodecahedrane
SpectraBase Compound ID FIq1l6X2xJJ
InChI InChI=1S/C22H23NO/c1-2(24)23-22-19-13-7-4-3-5-9(7)15(19)17-11(5)12-6(3)10-8(4)14(13)20(22)16(10)18(12)21(17)22/h3-21H,1H3,(H,23,24)
InChIKey OFQFMNKPIBXQQH-UHFFFAOYSA-N
Mol Weight 317.43 g/mol
Molecular Formula C22H23NO
Exact Mass 317.177964 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6Dstf93F5Nf
Name Acetylamino-dodecahedrane
Comments CHEMICAL BONDS BETWEEN C1-C5 AND C1-C11 ARE NOT REPRESENTABLE
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Formula C22H23NO
InChI InChI=1S/C22H23NO/c1-2(24)23-22-19-13-7-4-3-5-9(7)15(19)17-11(5)12-6(3)10-8(4)14(13)20(22)16(10)18(12)21(17)22/h3-21H,1H3,(H,23,24)
InChIKey OFQFMNKPIBXQQH-UHFFFAOYSA-N
Instrument Name SF = 300 MHz
Literature Reference L.A. Paquette, J.C. Weber, T. Kobayashi, J. Am. Chem. Soc. 110, 8591 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3