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TERT.-BUTYL-2-(TERT.-BUTOXYCARBONYLAMINO)-DODEC-5-ENOATE
SpectraBase Compound ID FMk70PVnx9s
InChI InChI=1S/2C21H39NO4/c2*1-8-9-10-11-12-13-14-15-16-17(18(23)25-20(2,3)4)22-19(24)26-21(5,6)7/h2*13-14,17H,8-12,15-16H2,1-7H3,(H,22,24)/b14-13+;14-13-
InChIKey KBTLKYCUHZGWFH-ZKUPANGQSA-N
Mol Weight 739.1 g/mol
Molecular Formula C42H78N2O8
Exact Mass 738.575817 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9MDKsXrvHGV
Name TERT.-BUTYL-2-(TERT.-BUTOXYCARBONYLAMINO)-DODEC-5-ENOATE
Compound Number 27
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H78N2O8
InChI InChI=1S/2C21H39NO4/c2*1-8-9-10-11-12-13-14-15-16-17(18(23)25-20(2,3)4)22-19(24)26-21(5,6)7/h2*13-14,17H,8-12,15-16H2,1-7H3,(H,22,24)/b14-13+;14-13-
InChIKey KBTLKYCUHZGWFH-ZKUPANGQSA-N
Literature Reference Author S.C.G.BIAGINI,S.E.GIBSON,S.P.KEEN
Literature Reference Citation J.CHEM.SOC.PERKIN-1,2485(1998)
Literature Reference DOI 10.1039/a804147d
Molecular Weight 739.090 g/mol
Solvent CDCl3
Source File Reference UWBS1310