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2-(3,5-Dimethylphenyl)-5,5-dimethyl-1,3,2-dioxaborinane
SpectraBase Compound ID DjSmi6ea0u8
InChI InChI=1S/C13H19BO2/c1-10-5-11(2)7-12(6-10)14-15-8-13(3,4)9-16-14/h5-7H,8-9H2,1-4H3
InChIKey DVLRVFZZFQHHRB-UHFFFAOYSA-N
Mol Weight 218.1 g/mol
Molecular Formula C13H19BO2
Exact Mass 218.14781 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K7i4eGt0ki6
Name 2-(3,5-Dimethylphenyl)-5,5-dimethyl-1,3,2-dioxaborinane
Appearance White solid
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Exact Mass 218.147810020 u
Formula C13H19BO2
InChI InChI=1S/C13H19BO2/c1-10-5-11(2)7-12(6-10)14-15-8-13(3,4)9-16-14/h5-7H,8-9H2,1-4H3
InChIKey DVLRVFZZFQHHRB-UHFFFAOYSA-N
Instrument Name Agilent Technologies 5973N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201603068
Molecular Weight 218.103 g/mol
SMILES C1(=CC(=CC(=C1)C)B1OCC(CO1)(C)C)C
SPLASH splash10-00lr-2950000000-33112a69c23a29afb766
Source of Spectrum ACI-55-SM18-3ka (DOI: 10.1002/anie.201603068)
Wiley ID 1901000