Wiley SpectraBase; SpectraBase Compound ID=H9ejs79Bi1 SpectraBase Spectrum ID=2IX7YiAmz8k
http://spectrabase.com/spectrum/2IX7YiAmz8k (accessed Aug 12, 2020).

ALL-TRANS-[U-(13)C(15)]-3-METHYL-5-(2,6,6-TRIMETHYL-CYCLOHEX-1-ENYL)-PENTA-2,4-DIENENITRILE
SpectraBase Compound ID H9ejs79Bi1
InChI InChI=1S/C15H21N/c1-12(9-11-16)7-8-14-13(2)6-5-10-15(14,3)4/h7-9H,5-6,10H2,1-4H3/b8-7+,12-9+/i1+1,2+1,3+1,4+1,5+1,6+1,7+1,8+1,9+1,10+1,11+1,12+1,13+1,14+1,15+1
InChIKey YOYODHNOTKUUDY-AWEVIDIMSA-N
Mol Weight 230.23 g/mol
Molecular Formula 13C15H21N
Exact Mass 230.217722 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2IX7YiAmz8k
SpectraBase Batch ID B09nkEkAZXm
Name ALL-TRANS-[U-(13)C(15)]-3-METHYL-5-(2,6,6-TRIMETHYL-CYCLOHEX-1-ENYL)-PENTA-2,4-DIENENITRILE
Compound Number 4
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula 13C15H21N
InChI InChI=1S/C15H21N/c1-12(9-11-16)7-8-14-13(2)6-5-10-15(14,3)4/h7-9H,5-6,10H2,1-4H3/b8-7+,12-9+/i1+1,2+1,3+1,4+1,5+1,6+1,7+1,8+1,9+1,10+1,11+1,12+1,13+1,14+1,15+1
InChIKey YOYODHNOTKUUDY-AWEVIDIMSA-N
Literature Reference Author A.F.L.CREEMERS,J.LUGTENBURG
Literature Reference Citation J.AM.CHEM.SOC.,124,6324(2002)
Literature Reference DOI 10.1021/ja012368h
Molecular Weight 230.224 g/mol
Sample ID 50434
Solvent CDCl3
SpectraBase Compound ID H9ejs79Bi1