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4-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)-N-methylbenzamide
SpectraBase Compound ID 9Bs2uBmtFJP
InChI InChI=1S/C13H18BNO3/c1-13(2)8-17-14(18-9-13)11-6-4-10(5-7-11)12(16)15-3/h4-7H,8-9H2,1-3H3,(H,15,16)
InChIKey CBBGBCYFWSLLGI-UHFFFAOYSA-N
Mol Weight 247.1 g/mol
Molecular Formula C13H18BNO3
Exact Mass 247.137974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J3IGO3g6sfI
Name 4-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)-N-methylbenzamide
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 247.137973611 u
Formula C13H18BNO3
InChI InChI=1S/C13H18BNO3/c1-13(2)8-17-14(18-9-13)11-6-4-10(5-7-11)12(16)15-3/h4-7H,8-9H2,1-3H3,(H,15,16)
InChIKey CBBGBCYFWSLLGI-UHFFFAOYSA-N
Instrument Name Agilent Technologies 5973N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201603068
Molecular Weight 247.101 g/mol
Quality 232
SMILES N(C(C=1C=CC(=CC1)B1OCC(C)(C)CO1)=O)C
SPLASH splash10-014j-1190000000-3bd9e59673f8b58287c5
Source of Spectrum ACI-55-SM21-3oa (DOI: 10.1002/anie.201603068)
Wiley ID 1901004