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Rac-1-(2,4,6-Trimethylphenyl)-1,4-butandiol
SpectraBase Compound ID JOOaPKLVM1T
InChI InChI=1S/C13H20O2/c1-9-7-10(2)13(11(3)8-9)12(15)5-4-6-14/h7-8,12,14-15H,4-6H2,1-3H3
InChIKey SAZROBXJUUJLFQ-UHFFFAOYSA-N
Mol Weight 208.3 g/mol
Molecular Formula C13H20O2
Exact Mass 208.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8CjyzJyN3Vl
Name Rac-1-(2,4,6-Trimethylphenyl)-1,4-butandiol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O2
InChI InChI=1S/C13H20O2/c1-9-7-10(2)13(11(3)8-9)12(15)5-4-6-14/h7-8,12,14-15H,4-6H2,1-3H3
InChIKey SAZROBXJUUJLFQ-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol4026588
Molecular Weight 208.301 g/mol
SMILES OCCCC(O)c1c(cc(cc1C)C)C
SPLASH splash10-0005-1900000000-eb5171c8ecb4879cf2f0
Source of Spectrum A1-15-5178/SMS81-rac_7e
Synonyms 1-Mesitylbutane-1,4-diol 1-(2,4,6-trimethylphenyl)butane-1,4-diol
Wiley ID 1751051