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12-O-(3-(1-(4-NITROBENZYL)-1H-1,2,3-TRIAZOL-4-YL)-PROPANOYLOXY)-11,20-EPOXYABIETA-8,11,13-TRIEN-20-ONE
SpectraBase Compound ID 81GoQFI2H9u
InChI InChI=1S/C32H36N4O6/c1-19(2)24-16-21-8-12-25-31(3,4)14-5-15-32(25)27(21)29(42-30(32)38)28(24)41-26(37)13-9-22-18-35(34-33-22)17-20-6-10-23(11-7-20)36(39)40/h6-7,10-11,16,18-19,25H,5,8-9,12-15,17H2,1-4H3/t25-,32+/m0/s1
InChIKey QYTSVDYFQPMVBB-ZOYWYXQUSA-N
Mol Weight 572.7 g/mol
Molecular Formula C32H36N4O6
Exact Mass 572.263485 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FB2F4cTJmLP
Name 12-O-(3-(1-(4-NITROBENZYL)-1H-1,2,3-TRIAZOL-4-YL)-PROPANOYLOXY)-11,20-EPOXYABIETA-8,11,13-TRIEN-20-ONE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H36N4O6
InChI InChI=1S/C32H36N4O6/c1-19(2)24-16-21-8-12-25-31(3,4)14-5-15-32(25)27(21)29(42-30(32)38)28(24)41-26(37)13-9-22-18-35(34-33-22)17-20-6-10-23(11-7-20)36(39)40/h6-7,10-11,16,18-19,25H,5,8-9,12-15,17H2,1-4H3/t25-,32+/m0/s1
InChIKey QYTSVDYFQPMVBB-ZOYWYXQUSA-N
Literature Reference Author M.W.PERTINO,C.THEODULOZ,E.BUTASSI,S.ZACCHINO,G.SCHMEDA-HIRSC HMANN
Literature Reference Citation MOLECULES,20,8666(2015)
Literature Reference DOI 10.3390/molecules20058666
Molecular Weight 572.661 g/mol
Solvent CDCl3
Source File Reference UWPA3146