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4-NC-C6H4-B-(O2C2ME4)
SpectraBase Compound ID 2FlXCmNQtJN
InChI InChI=1S/C13H16BNO2/c1-12(2)13(3,4)17-14(16-12)11-7-5-10(9-15)6-8-11/h5-8H,1-4H3
InChIKey HOPDTPGXBZCBNP-UHFFFAOYSA-N
Mol Weight 229.1 g/mol
Molecular Formula C13H16BNO2
Exact Mass 229.127409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ew8YbAIldfn
Name 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
Appearance Pale yellow solid
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Exact Mass 229.127408927 u
Formula C13H16BNO2
InChI InChI=1S/C13H16BNO2/c1-12(2)13(3,4)17-14(16-12)11-7-5-10(9-15)6-8-11/h5-8H,1-4H3
InChIKey HOPDTPGXBZCBNP-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1021/jo3018878
Molecular Weight 229.086 g/mol
Quality 126
SMILES C1=CC(=CC=C1C#N)B1OC(C(O1)(C)C)(C)C
SPLASH splash10-03dl-1980000000-807e6cfa7d1e644d82f7
Source of Spectrum JOC-78-1927-4ag (DOI: 10.1021/jo3018878)
Wiley ID 1912293