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[28,28,28-(2)H(3)]-ALPHA-AMYRIN

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[28,28,28-(2)H(3)]-ALPHA-AMYRIN
SpectraBase Compound ID FwHk7ffGeoW
InChI InChI=1S/C30H50O/c1-25(2)15-16-27(5)17-18-29(7)20(21(27)19-25)9-10-23-28(6)13-12-24(31)26(3,4)22(28)11-14-30(23,29)8/h9,21-24,31H,10-19H2,1-8H3/t21-,22?,23?,24-,27+,28-,29+,30+/m0/s1/i5D3
InChIKey JFSHUTJDVKUMTJ-YANBMBKQSA-N
Mol Weight 429.7 g/mol
Molecular Formula C30H472H3O
Exact Mass 429.404996 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B03I3eE8LuL
Name [28,28,28-(2)H(3)]-ALPHA-AMYRIN
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H472H3O
InChI InChI=1S/C30H50O/c1-25(2)15-16-27(5)17-18-29(7)20(21(27)19-25)9-10-23-28(6)13-12-24(31)26(3,4)22(28)11-14-30(23,29)8/h9,21-24,31H,10-19H2,1-8H3/t21-,22?,23?,24-,27+,28-,29+,30+/m0/s1/i5D3
InChIKey JFSHUTJDVKUMTJ-YANBMBKQSA-N
Literature Reference Author K.OHYAMA,M.SUZUKI,K.MASUDA,S.YOSHIDA,T.MURANAKA
Literature Reference Citation CHEM.PHARM.BULL.,55,1518(2007)
Literature Reference DOI 10.1248/cpb.55.1518
Molecular Weight 429.745 g/mol
Sample ID 33474
Solvent CDCl3