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Megastigm-5-ene-3,4,9-triols
SpectraBase Compound ID A8zdtdDMj2E
InChI InChI=1S/C13H24O3/c1-9(14)5-6-10-7-13(4,16)11(15)8-12(10,2)3/h7,9,11,14-16H,5-6,8H2,1-4H3
InChIKey DPBOANPRMCTPQW-UHFFFAOYSA-N
Mol Weight 228.33 g/mol
Molecular Formula C13H24O3
Exact Mass 228.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JS6RqPG1hMW
Name Megastigm-5-ene-3,4,9-triols
Alternate Name(s) 4-(3-hydroxybutyl)-2,5,5-trimethyl-3-cyclohexene-1,2-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H24O3
InChI InChI=1S/C13H24O3/c1-9(14)5-6-10-7-13(4,16)11(15)8-12(10,2)3/h7,9,11,14-16H,5-6,8H2,1-4H3
InChIKey DPBOANPRMCTPQW-UHFFFAOYSA-N
Molecular Weight 228.332 g/mol
SMILES OC1(C=C(CCC(O)C)C(CC1O)(C)C)C
SPLASH splash10-052f-9400000000-10c621b4a24879ffd742
Source of Spectrum LQ-1992-4122-0
Wiley ID 1229757