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4-[2-(Quinolin-2-yl)phenyl]-3,4-dihydrobenzo[e][1,2,3]oxathiazine 2,2-dioxide
SpectraBase Compound ID 7PJ4l4Jj57L
InChI InChI=1S/C22H16N2O3S/c25-28(26)24-22(18-10-4-6-12-21(18)27-28)17-9-3-2-8-16(17)20-14-13-15-7-1-5-11-19(15)23-20/h1-14,22,24H
InChIKey XLSHPNYNIUBAER-UHFFFAOYSA-N
Mol Weight 388.44 g/mol
Molecular Formula C22H16N2O3S
Exact Mass 388.088164 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6VBtPjlrCvl
Name 4-[2-(Quinolin-2-yl)phenyl]-3,4-dihydrobenzo[e][1,2,3]oxathiazine 2,2-dioxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H16N2O3S
InChI InChI=1S/C22H16N2O3S/c25-28(26)24-22(18-10-4-6-12-21(18)27-28)17-9-3-2-8-16(17)20-14-13-15-7-1-5-11-19(15)23-20/h1-14,22,24H
InChIKey XLSHPNYNIUBAER-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol500918t
Molecular Weight 388.441 g/mol
SMILES N1S(Oc2ccccc2C1c1c(-c2nc3c(cccc3)cc2)cccc1)(=O)=O
SPLASH splash10-00di-0089000000-2474f2dc3d79f1aea37e
Source of Spectrum A1-16-2538/SMS6-3k
Wiley ID 1749510