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CIS-TRANS-7-OXO-3,11-DIPENTYL-DISPIRO-[5.1.5.2]-PENTADECAN-3,11-DICARBONITRILE
SpectraBase Compound ID KY5LDp90bkJ
InChI InChI=1S/C27H42N2O/c1-3-5-7-9-24(21-28)11-15-26(16-12-24)19-20-27(23(26)30)17-13-25(22-29,14-18-27)10-8-6-4-2/h3-20H2,1-2H3/t24-,25-,26-,27+
InChIKey XWSJZTFECQQODI-HDDLTCNGSA-N
Mol Weight 410.6 g/mol
Molecular Formula C27H42N2O
Exact Mass 410.329714 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9nkIBF4s5kN
Name CIS-TRANS-7-OXO-3,11-DIPENTYL-DISPIRO-[5.1.5.2]-PENTADECAN-3,11-DICARBONITRILE
CAS Registry Number 139564-63-9
Compound Number 11B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H42N2O
InChI InChI=1S/C27H42N2O/c1-3-5-7-9-24(21-28)11-15-26(16-12-24)19-20-27(23(26)30)17-13-25(22-29,14-18-27)10-8-6-4-2/h3-20H2,1-2H3/t24-,25-,26-,27+
InChIKey XWSJZTFECQQODI-HDDLTCNGSA-N
Literature Reference Author J.BOETTCHER,R.HARTMANN,F.VOEGTLE
Literature Reference Citation CHEM.BER.,125,1865(1992)
Literature Reference DOI 10.1002/cber.19921250813
Molecular Weight 410.643 g/mol
Solvent C6D6
Source File Reference UWCS13296