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Mandelic acid, monoanhydride with 1-butaneboronic acid, cyclic ester
SpectraBase Compound ID 1rxWz71WdLf
InChI InChI=1S/C12H15BO3/c1-2-3-9-13-15-11(12(14)16-13)10-7-5-4-6-8-10/h4-8,11H,2-3,9H2,1H3
InChIKey FTDWKNIOHBDPLK-UHFFFAOYSA-N
Mol Weight 218.1 g/mol
Molecular Formula C12H15BO3
Exact Mass 218.111425 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9buKuCbm0GR
Name Mandelic acid, monoanhydride with 1-butaneboronic acid, cyclic ester
CAS Registry Number 24372-03-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15BO3
InChI InChI=1S/C12H15BO3/c1-2-3-9-13-15-11(12(14)16-13)10-7-5-4-6-8-10/h4-8,11H,2-3,9H2,1H3
InChIKey FTDWKNIOHBDPLK-UHFFFAOYSA-N
Molecular Weight 218.059 g/mol
SMILES C(B1OC(c2ccccc2)C(=O)O1)CCC
SPLASH splash10-00kf-9800000000-12fa734fd52c0d1c3f15
Source of Spectrum AD-0-5109-0
Synonyms 2-Butyl-5-phenyl-1,3,2-dioxaborolan-4-one Mandelic acid cyclic butaneboronate
Wiley ID 27865