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B-Amyrin
SpectraBase Compound ID JthnekpPW29
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
InChIKey JFSHUTJDVKUMTJ-QHPUVITPSA-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 HvJ94fE3Uxa
Name beta-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/c1-25(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
InChIKey JFSHUTJDVKUMTJ-QHPUVITPSA-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(CC[C@]2([C@](C1(C)C)(CC[C@@]1([C@@]2(CC=C2[C@]1(CC[C@@]1([C@]2(CC(CC1)(C)C)[H])C)C)[H])C)[H])C)[H]
SPLASH splash10-014i-0190100000-c0d393e23073718a1adb
Source of Spectrum SFA-91-2366-beta-Amirin (DOI: 10.1002/jsfa.4468)
Wiley ID 1838627