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3-BETA-PHENYLACETOXY-URS-12-ENE
SpectraBase Compound ID LthjAofePKh
InChI InChI=1S/C38H56O2/c1-25-16-19-35(5)22-23-37(7)28(33(35)26(25)2)14-15-30-36(6)20-18-31(34(3,4)29(36)17-21-38(30,37)8)40-32(39)24-27-12-10-9-11-13-27/h9-14,25-26,29-31,33H,15-24H2,1-8H3/t25-,26+,29+,30-,31+,33+,35-,36+,37-,38-/m1/s1
InChIKey GJPKTQOFZAVPOY-MCEUYYPSSA-N
Mol Weight 544.9 g/mol
Molecular Formula C38H56O2
Exact Mass 544.428031 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J3jRtNZ2k3v
Name 3-BETA-PHENYLACETOXY-URS-12-ENE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H56O2
InChI InChI=1S/C38H56O2/c1-25-16-19-35(5)22-23-37(7)28(33(35)26(25)2)14-15-30-36(6)20-18-31(34(3,4)29(36)17-21-38(30,37)8)40-32(39)24-27-12-10-9-11-13-27/h9-14,25-26,29-31,33H,15-24H2,1-8H3/t25-,26+,29+,30-,31+,33+,35-,36+,37-,38-/m1/s1
InChIKey GJPKTQOFZAVPOY-MCEUYYPSSA-N
Literature Reference Author M.D.P.LIMA,P.A.C.BRAGA,M.L.MACEDO,M.F.D.G.F.D.SILVA,A.G.FERR EIRA,J.B.FERNANDES,P
Literature Reference Citation J.BRAZ.CHEM.SOC.,15,385(2004)
Literature Reference DOI 10.1590/s0103-50532004000300008
Molecular Weight 544.861 g/mol
Solvent Unknown
Source File Reference UWLU7012