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2-(4-Methyl-3-nitrophenyl)-1,3,2-dioxaborinane
SpectraBase Compound ID FXQ8DQB7FxS
InChI InChI=1S/C10H12BNO4/c1-8-3-4-9(7-10(8)12(13)14)11-15-5-2-6-16-11/h3-4,7H,2,5-6H2,1H3
InChIKey QSJDSAYYNOVVTP-UHFFFAOYSA-N
Mol Weight 221.0 g/mol
Molecular Formula C10H12BNO4
Exact Mass 221.085938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JnaszyPWXh0
Name 2-(4-Methyl-3-nitrophenyl)-1,3,2-dioxaborinane
CAS Registry Number 80279-22-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12BNO4
InChI InChI=1S/C10H12BNO4/c1-8-3-4-9(7-10(8)12(13)14)11-15-5-2-6-16-11/h3-4,7H,2,5-6H2,1H3
InChIKey QSJDSAYYNOVVTP-UHFFFAOYSA-N
Molecular Weight 221.019 g/mol
SMILES c1(B2OCCCO2)ccc(C)c(c1)N(=O)=O
SPLASH splash10-0gb9-5940000000-efe0384afae5b4aa44a4
Source of Spectrum 0-16-324-3
Wiley ID 1221101