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(1R,SR,6S,7S)-6-METHYL-5,11-DIOXA-2-AZA-TRICYCLO-[5.3.1.0]-UNDECAN-8-YLIDENE-MALONO-NITRILE
SpectraBase Compound ID FD96KjA3GIT
InChI InChI=1S/C12H13N3O2/c1-12-11-9(8(6-13)7-14)2-3-10(17-11)15(12)4-5-16-12/h10-11H,2-5H2,1H3/t10-,11+,12?/m0/s1
InChIKey GTAYIDXJQXQZLL-WIKAKEFZSA-N
Mol Weight 231.25 g/mol
Molecular Formula C12H13N3O2
Exact Mass 231.100777 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3PuZLKeeZob
Name (1R,SR,6S,7S)-6-METHYL-5,11-DIOXA-2-AZA-TRICYCLO-[5.3.1.0]-UNDECAN-8-YLIDENE-MALONO-NITRILE
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H13N3O2
InChI InChI=1S/C12H13N3O2/c1-12-11-9(8(6-13)7-14)2-3-10(17-11)15(12)4-5-16-12/h10-11H,2-5H2,1H3/t10-,11+,12?/m0/s1
InChIKey GTAYIDXJQXQZLL-WIKAKEFZSA-N
Literature Reference Author M.KOTERA,K.ISHII,M.HIRAGA,M.SAKAMOTO
Literature Reference Citation HETEROCYCLES,51,2147(1999)
Literature Reference DOI 10.3987/COM-99-8570
Molecular Weight 231.254 g/mol
Solvent CDCl3
Source File Reference UWSW653