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nor - beta - amyrone3 - oxo - 28 - nor - olean - 12 - ene
SpectraBase Compound ID HbRs8WrxKbK
InChI InChI=1S/C29H46O/c1-25(2)14-10-19-11-16-28(6)21(20(19)18-25)8-9-23-27(5)15-13-24(30)26(3,4)22(27)12-17-29(23,28)7/h8,19-20,22-23H,9-18H2,1-7H3/t19?,20-,22-,23+,27-,28+,29+/m0/s1
InChIKey QQKXTWZLGUEVGX-COIPAKFFSA-N
Mol Weight 410.7 g/mol
Molecular Formula C29H46O
Exact Mass 410.354866 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2poKUjWSOeA
Name nor - beta - amyrone3 - oxo - 28 - nor - olean - 12 - ene
Comments Less than 3 mono-isotopic peaks
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Formula C29H46O
InChI InChI=1S/C29H46O/c1-25(2)14-10-19-11-16-28(6)21(20(19)18-25)8-9-23-27(5)15-13-24(30)26(3,4)22(27)12-17-29(23,28)7/h8,19-20,22-23H,9-18H2,1-7H3/t19?,20-,22-,23+,27-,28+,29+/m0/s1
InChIKey QQKXTWZLGUEVGX-COIPAKFFSA-N
Molecular Weight 410.686 g/mol
SMILES [C@@]12([C@]3([C@]([C@@]4([C@@](C(C(=O)CC4)(C)C)([H])CC3)C)([H])CC=C1[C@]1(CC(CCC1CC2)(C)C)[H])C)C
SPLASH splash10-0udi-0090100000-169c7901e48d3cdb214e
Source of Spectrum Va-0-0-0
Synonyms nor-.beta.-amyrone3-oxo-28-nor-olean-12-ene
Wiley ID 741340