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3-Aza-tricyclo(7.4.0.0/3,7/)tridec-1-en-4-one
SpectraBase Compound ID 8jlOHDkX1GX
InChI InChI=1S/C12H17NO/c14-12-6-5-11-7-9-3-1-2-4-10(9)8-13(11)12/h8-9,11H,1-7H2
InChIKey SCTUHXIAQHYXDF-UHFFFAOYSA-N
Mol Weight 191.27 g/mol
Molecular Formula C12H17NO
Exact Mass 191.131014 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID VTCbTLZSnP
Name 3-Aza-tricyclo(7.4.0.0/3,7/)tridec-1-en-4-one
Comments ISOMER 2 WITH RESPECT TO CONFIGURATION OF C6, HIGH FIELD SHIFTS
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H17NO
InChI InChI=1S/C12H17NO/c14-12-6-5-11-7-9-3-1-2-4-10(9)8-13(11)12/h8-9,11H,1-7H2
InChIKey SCTUHXIAQHYXDF-UHFFFAOYSA-N
Instrument Name Nicolet 300 M
Literature Reference Y.S. Cheng, A.T. Lupo, F.W.Fowler, J. Am. Chem. Soc. 105, 7696 (1983).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3