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14Alpha-taraxeran-3-one
SpectraBase Compound ID Kbeb918lagp
InChI InChI=1S/C30H50O/c1-25(2)17-18-27(5)13-9-21-29(7)14-10-20-26(3,4)24(31)12-16-28(20,6)22(29)11-15-30(21,8)23(27)19-25/h20-23H,9-19H2,1-8H3/t20-,21-,22+,23+,27-,28-,29-,30+/m0/s1
InChIKey MFVJCHSUSSRHRH-AIRAMVRTSA-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 4P9x47bxaDb
Name 14alpha-Taraxeran-3-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H50O
InChI InChI=1S/C30H50O/c1-25(2)17-18-27(5)13-9-21-29(7)14-10-20-26(3,4)24(31)12-16-28(20,6)22(29)11-15-30(21,8)23(27)19-25/h20-23H,9-19H2,1-8H3/t20-,21-,22+,23+,27-,28-,29-,30+/m0/s1
InChIKey MFVJCHSUSSRHRH-AIRAMVRTSA-N
Literature Reference DOI 10.1002/jccs.200200042
Molecular Weight 426.729 g/mol
SMILES C1C[C@]2([C@](C(C1=O)(C)C)(CC[C@@]1([C@@]2(CC[C@@]2([C@]1(CC[C@@]1([C@]2(CC(CC1)(C)C)[H])C)[H])C)[H])C)[H])C
SPLASH splash10-00ba-3632900000-4a382e9e8363e2bb4adf
Source of Spectrum QA-49-272-6
Synonyms (4aR,6aS,6bR,8aS,12aR,12bS,14aS,14bR)-4,4,6a,8a,11,11,12b,14b-octamethylicosahydropicen-3(2H)-one
Wiley ID 1795588