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(+/-)-All-cis-cyclohexane-1,2,4-triol
SpectraBase Compound ID LKEcbtrNrtI
InChI InChI=1S/C6H12O3/c7-4-1-2-5(8)6(9)3-4/h4-9H,1-3H2/t4-,5+,6-/m1/s1
InChIKey ZHMPXIDAUXCKIQ-NGJCXOISSA-N
Mol Weight 132.16 g/mol
Molecular Formula C6H12O3
Exact Mass 132.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KiVSvFRaBMY
Name (+/-)-All-cis-cyclohexane-1,2,4-triol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 132.078644243 u
Formula C6H12O3
InChI InChI=1S/C6H12O3/c7-4-1-2-5(8)6(9)3-4/h4-9H,1-3H2/t4-,5+,6-/m1/s1
InChIKey ZHMPXIDAUXCKIQ-NGJCXOISSA-N
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0004.404
Molecular Weight 132.159 g/mol
Quality 806
SMILES O[C@@]1(CC[C@@]([C@@](C1)(O)[H])(O)[H])[H]
SPLASH splash10-05fu-9000000000-702e8b5dfb6853ca9e09
Source of Spectrum ARK-2003-49-1 (DOI: 10.3998/ark.5550190.0004.404)
Thin-Layer Chromatography 0.16 (CH2Cl2/MeOH, 9:1)
Wiley ID 1899922