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(4R,5R,7S,8R,9S,10S,11S)-7,8,9-Trihydroxyjiquilp-3(12)-ene
SpectraBase Compound ID 9nocTR6x9aw
InChI InChI=1S/C15H24O3/c1-7-5-8-6-9-10(7)15(8,4)13(18)11(16)12(17)14(9,2)3/h8-13,16-18H,1,5-6H2,2-4H3/t8-,9-,10-,11+,12+,13-,15+/m0/s1
InChIKey DAASHTBRGSTLDB-YRTQZTBLSA-N
Mol Weight 252.35 g/mol
Molecular Formula C15H24O3
Exact Mass 252.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JLvbzfHY46R
Name (4R,5R,7S,8R,9S,10S,11S)-7,8,9-Trihydroxyjiquilp-3(12)-ene
Appearance White needles
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O3
InChI InChI=1S/C15H24O3/c1-7-5-8-6-9-10(7)15(8,4)13(18)11(16)12(17)14(9,2)3/h8-13,16-18H,1,5-6H2,2-4H3/t8-,9-,10-,11+,12+,13-,15+/m0/s1
InChIKey DAASHTBRGSTLDB-YRTQZTBLSA-N
Instrument Name Hewlett-Packard 5989A or Hewlett Packard 5989B or Saturn 2000
Ionization Type EI
Literature Reference DOI 10.1021/np0201570
Molecular Weight 252.354 g/mol
Optical Rotation [a]D = +50 (589 nm), +52 (578 nm), +58 (546 nm), +97 (436 nm), +152 (365 nm) (c = 0.2, CHCl3)
Reported Formula C15H24O3
SMILES O[C@@]1([C@]2([C@@]3([C@@](C([C@@]([C@]1(O)[H])(O)[H])(C)C)(C[C@@]2(CC3=C)[H])[H])[H])C)[H]
SPLASH splash10-0596-5910000000-5f82bf5660eec20d1793
Source of Spectrum G4-65-1544-12
Wiley ID 1883470