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Syn-tert-butyl 3-hydroxy-2-methyl-3-(4-methyl-phenyl)butanoate
SpectraBase Compound ID KLKZoi9CTnR
InChI InChI=1S/C16H24O3/c1-11-7-9-13(10-8-11)16(6,18)12(2)14(17)19-15(3,4)5/h7-10,12,18H,1-6H3/t12-,16+/m0/s1
InChIKey XGVOPZVJBFTIDU-BLLLJJGKSA-N
Mol Weight 264.36 g/mol
Molecular Formula C16H24O3
Exact Mass 264.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1QD7FIDsgKB
Name Syn-tert-butyl 3-hydroxy-2-methyl-3-(4-methyl-phenyl)butanoate
Alternate Name(s) (2R,3R)-tert-butyl 3-hydroxy-2-methyl-3-(p-tolyl)butanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H24O3
InChI InChI=1S/C16H24O3/c1-11-7-9-13(10-8-11)16(6,18)12(2)14(17)19-15(3,4)5/h7-10,12,18H,1-6H3/t12-,16+/m0/s1
InChIKey XGVOPZVJBFTIDU-BLLLJJGKSA-N
Literature Reference DOI 10.1002/cjoc.201300036
Molecular Weight 264.365 g/mol
SMILES O[C@@](c1ccc(cc1)C)([C@@](C)(C(OC(C)(C)C)=O)[H])C
SPLASH splash10-000l-2900000000-964d166cc6fb62e80830
Source of Spectrum CJC-31-539/SM14-syn_8F
Wiley ID 1772852