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4-(Benzyl)-3-ethylhexan-3,6-diol
SpectraBase Compound ID 9q7RGEJl9s2
InChI InChI=1S/C15H24O2/c1-3-15(17,4-2)14(10-11-16)12-13-8-6-5-7-9-13/h5-9,14,16-17H,3-4,10-12H2,1-2H3
InChIKey KURRCNQZCYEKDD-UHFFFAOYSA-N
Mol Weight 236.35 g/mol
Molecular Formula C15H24O2
Exact Mass 236.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HFQNfjcTpP6
Name 4-(Benzyl)-3-ethylhexan-3,6-diol
Alternate Name(s) 3-benzyl-4-ethyl-1,4-hexanediol
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O2
InChI InChI=1S/C15H24O2/c1-3-15(17,4-2)14(10-11-16)12-13-8-6-5-7-9-13/h5-9,14,16-17H,3-4,10-12H2,1-2H3
InChIKey KURRCNQZCYEKDD-UHFFFAOYSA-N
Molecular Weight 236.355 g/mol
SMILES OCCC(C(CC)(O)CC)Cc1ccccc1
SPLASH splash10-0006-9000000000-6423dbc4209b1eb88328
Source of Spectrum SO-0-957-8
Wiley ID 1541686