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[2R-(2a,3Aa, 4b,7b,7aa)]-[(octahydro-7,8,8-trimethyl-4,7-methano-benzofuran-2-yl)oxy]-acetonitrile

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[2R-(2a,3Aa, 4b,7b,7aa)]-[(octahydro-7,8,8-trimethyl-4,7-methano-benzofuran-2-yl)oxy]-acetonitrile
SpectraBase Compound ID Ia2PgD517Ya
InChI InChI=1S/C14H21NO2/c1-13(2)10-4-5-14(13,3)12-9(10)8-11(17-12)16-7-6-15/h9-12H,4-5,7-8H2,1-3H3/t9-,10-,11?,12-,14+/m1/s1
InChIKey KIYHAABPXKVGPH-HSLYTFOJSA-N
Mol Weight 235.33 g/mol
Molecular Formula C14H21NO2
Exact Mass 235.157229 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID oSXvyKMqK4
Name [2R-(2a,3Aa, 4b,7b,7aa)]-[(octahydro-7,8,8-trimethyl-4,7-methano-benzofuran-2-yl)oxy]-acetonitrile
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C14H21NO2
InChI InChI=1S/C14H21NO2/c1-13(2)10-4-5-14(13,3)12-9(10)8-11(17-12)16-7-6-15/h9-12H,4-5,7-8H2,1-3H3/t9-,10-,11?,12-,14+/m1/s1
InChIKey KIYHAABPXKVGPH-HSLYTFOJSA-N
Literature Reference C.R. Noe, M. Knollmueller, G. Goestl, Angew. Chem. 99, 467 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3