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4-Methylbenzeneboronic acid neopentyl glycol ester
SpectraBase Compound ID 90BaUjJ4VnD
InChI InChI=1S/C12H17BO2/c1-10-4-6-11(7-5-10)13-14-8-12(2,3)9-15-13/h4-7H,8-9H2,1-3H3
InChIKey ZSPBWRPQSPRISS-UHFFFAOYSA-N
Mol Weight 204.1 g/mol
Molecular Formula C12H17BO2
Exact Mass 204.13216 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HcmwaSyk58f
Name 5,5-Dimethyl-2-(p-tolyl)-1,3,2-dioxaborinane
Appearance White solid
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Exact Mass 204.132159955 u
Formula C12H17BO2
InChI InChI=1S/C12H17BO2/c1-10-4-6-11(7-5-10)13-14-8-12(2,3)9-15-13/h4-7H,8-9H2,1-3H3
InChIKey ZSPBWRPQSPRISS-UHFFFAOYSA-N
Instrument Name Agilent Technologies 5973N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201603068
Molecular Weight 204.076 g/mol
SMILES C1=CC(=CC=C1C)B1OCC(CO1)(C)C
SPLASH splash10-0uxr-3960000000-86b0d42e34d3f021d252
Source of Spectrum ACI-55-SM14-3ba (DOI: 10.1002/anie.201603068)
Wiley ID 1900991