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N-(Phenyl MIDA boronate-2-yl)-S-methyl-S-phenylsulfoximine
SpectraBase Compound ID 5hh55LNXeTN
InChI InChI=1S/C18H19BN2O5S/c1-21-12-17(22)25-19(26-18(23)13-21)15-10-6-7-11-16(15)20-27(2,24)14-8-4-3-5-9-14/h3-11H,12-13H2,1-2H3
InChIKey UIVNJOCFEXIFKH-UHFFFAOYSA-N
Mol Weight 386.2 g/mol
Molecular Formula C18H19BN2O5S
Exact Mass 386.110773 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CGCrTIAVbP5
Name N-(Phenyl MIDA boronate-2-yl)-S-methyl-S-phenylsulfoximine
Alternate Name(s) 6-Methyl-2-(2-((methyl(oxo)(phenyl)-lambda6-sulfaneylidene)amino)phenyl)-1,3,6,2-dioxazaborocane-4,8-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19BN2O5S
InChI InChI=1S/C18H19BN2O5S/c1-21-12-17(22)25-19(26-18(23)13-21)15-10-6-7-11-16(15)20-27(2,24)14-8-4-3-5-9-14/h3-11H,12-13H2,1-2H3
InChIKey UIVNJOCFEXIFKH-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201701394
Molecular Weight 386.229 g/mol
SMILES c1cccc(c1N=S(c1ccccc1)(C)=O)B1OC(CN(CC(O1)=O)C)=O
SPLASH splash10-0a4i-9101000000-d7f23c5314bf82ee3d29
Source of Spectrum ASC-360-SM8-2h
Wiley ID 1811783