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(5R*,6S)-5-exo-5-Cyano-2-aza-3-oxatetracyclo[7.3.1.1(7,11).0(2,6)]tetradecane
SpectraBase Compound ID IoUn2OzEBdj
InChI InChI=1S/C13H18N2O/c14-6-11-7-16-15-12-4-8-1-9(5-12)3-10(2-8)13(11)15/h8-13H,1-5,7H2/t8-,9+,10-,11-,12-,13+/m1/s1
InChIKey IBBPUJRMRXAUQV-KALVJPODSA-N
Mol Weight 218.3 g/mol
Molecular Formula C13H18N2O
Exact Mass 218.141913 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 17qK1Dujl5y
Name (5R*,6S)-5-exo-5-Cyano-2-aza-3-oxatetracyclo[7.3.1.1(7,11).0(2,6)]tetradecane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18N2O
InChI InChI=1S/C13H18N2O/c14-6-11-7-16-15-12-4-8-1-9(5-12)3-10(2-8)13(11)15/h8-13H,1-5,7H2/t8-,9+,10-,11-,12-,13+/m1/s1
InChIKey IBBPUJRMRXAUQV-KALVJPODSA-N
Molecular Weight 218.300 g/mol
SMILES [C@]12(N([C@]3(C[C@@]4(C[C@]2(C[C@](C3)(C4)[H])[H])[H])[H])OC[C@]1(C#N)[H])[H]
SPLASH splash10-014r-0910000000-1a7f9fab9699dd4acb1e
Source of Spectrum F-53-5420-3
Wiley ID 801679