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Chenopodiol <alpha->
SpectraBase Compound ID 2Toytwx6iCt
InChI InChI=1S/C15H26O2/c1-10-6-5-8-15(4)9-7-11(14(2,3)17)13(16)12(10)15/h6,11-13,16-17H,5,7-9H2,1-4H3/t11-,12-,13+,15-/m1/s1
InChIKey LBZDGNDASDARLL-GUIRCDHDSA-N
Mol Weight 238.37 g/mol
Molecular Formula C15H26O2
Exact Mass 238.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IIyv2trALvP
Name Chenopodiol
CAS Registry Number 67996-31-0
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.
Exact Mass 238.193280075 u
Formula C15H26O2
InChI InChI=1S/C15H26O2/c1-10-6-5-8-15(4)9-7-11(14(2,3)17)13(16)12(10)15/h6,11-13,16-17H,5,7-9H2,1-4H3/t11-,12-,13+,15-/m1/s1
InChIKey LBZDGNDASDARLL-GUIRCDHDSA-N
Molecular Weight 238.371 g/mol
Number of Peaks 50
RI1 1859
SMILES OC([C@@]1(CC[C@@]2([C@@]([C@]1(O)[H])(C(=CCC2)C)[H])C)[H])(C)C
SPLASH splash10-0a4l-9600000000-3a4d38267fc7c900d3a5
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 2-naphthalenemethanol, 1,2,3,4,4a,5,6,8a-octahydro-1-hydroxy-alpha,alpha,4a,8-tetramethyl-, (1R,2R,4aR,8aR)-
Wiley ID LM_FFNSC3_2602