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alpha-Amyrin
SpectraBase Compound ID Kkz2JXnEVu9
InChI InChI=1S/C30H50O/c1-19-11-14-27(5)17-18-29(7)21(25(27)20(19)2)9-10-23-28(6)15-13-24(31)26(3,4)22(28)12-16-30(23,29)8/h9,19-20,22-25,31H,10-18H2,1-8H3/t19-,20+,22+,23-,24+,25+,27-,28+,29-,30-/m1/s1
InChIKey FSLPMRQHCOLESF-SFMCKYFRSA-N
Mol Weight 426.7 g/mol
Molecular Formula C30H50O
Exact Mass 426.386166 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID eYS8xeew5j
Name alpha-Amirin
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Formula C30H50O
InChI InChI=1S/C30H50O/c1-19-11-14-27(5)17-18-29(7)21(25(27)20(19)2)9-10-23-28(6)15-13-24(31)26(3,4)22(28)12-16-30(23,29)8/h9,19-20,22-25,31H,10-18H2,1-8H3/t19-,20+,22+,23-,24+,25+,27-,28+,29-,30-/m1/s1
InChIKey FSLPMRQHCOLESF-SFMCKYFRSA-N
Instrument Name Hewlett-Packard 5890 series II-5989B
Ionization Type EI
Literature Reference DOI 10.1002/jsfa.4468
Molecular Weight 426.729 g/mol
Number of Peaks 5
SMILES O[C@@]1(C([C@]2([C@](CC1)([C@@]1([C@@](CC2)([C@]2(C(=CC1)[C@]1([C@@](CC2)(CC[C@]([C@@]1(C)[H])(C)[H])C)[H])C)C)[H])C)[H])(C)C)[H]
SPLASH splash10-014i-0190000000-c9c529ecf5a48adeaab6
Source of Spectrum SFA-91-2366-alpha-Amirin (DOI: 10.1002/jsfa.4468)
Wiley ID 1838625