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5-Amino-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-benzonitrile
SpectraBase Compound ID 44Wuq9vQLqo
InChI InChI=1S/C13H17BN2O2/c1-12(2)13(3,4)18-14(17-12)11-6-5-10(16)7-9(11)8-15/h5-7H,16H2,1-4H3
InChIKey IMUBORUZDYTZMI-UHFFFAOYSA-N
Mol Weight 244.1 g/mol
Molecular Formula C13H17BN2O2
Exact Mass 244.138308 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HjW0iDMRUDe
Name 5-Amino-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-benzonitrile
Alternate Name(s) 5-Amino-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile 5-Azanyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzenecarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17BN2O2
InChI InChI=1S/C13H17BN2O2/c1-12(2)13(3,4)18-14(17-12)11-6-5-10(16)7-9(11)8-15/h5-7H,16H2,1-4H3
InChIKey IMUBORUZDYTZMI-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo402618r
Molecular Weight 244.101 g/mol
SMILES Nc1cc(c(B2OC(C)(C(C)(O2)C)C)cc1)C#N
SPLASH splash10-0006-1890000000-9e36834fedeaf63cf132
Source of Spectrum J-79-1984-3g
Wiley ID 1746033