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4-{4-(Pyridin-2-yl)-[1,1'-biphenyl]-3-yl}-3,4-dihydrobenzo[e][1,2,3]oxathiazine 2,2-dioxide
SpectraBase Compound ID 9ikKjcgIbMS
InChI InChI=1S/C24H18N2O3S/c27-30(28)26-24(20-10-4-5-12-23(20)29-30)21-16-18(17-8-2-1-3-9-17)13-14-19(21)22-11-6-7-15-25-22/h1-16,24,26H
InChIKey IZFFGUCMNCYNMS-UHFFFAOYSA-N
Mol Weight 414.48 g/mol
Molecular Formula C24H18N2O3S
Exact Mass 414.103814 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3CPOEuIYBU
Name 4-{4-(Pyridin-2-yl)-[1,1'-biphenyl]-3-yl}-3,4-dihydrobenzo[e][1,2,3]oxathiazine 2,2-dioxide
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H18N2O3S
InChI InChI=1S/C24H18N2O3S/c27-30(28)26-24(20-10-4-5-12-23(20)29-30)21-16-18(17-8-2-1-3-9-17)13-14-19(21)22-11-6-7-15-25-22/h1-16,24,26H
InChIKey IZFFGUCMNCYNMS-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol500918t
Molecular Weight 414.479 g/mol
SMILES N1S(Oc2c(C1c1c(-c3ccccn3)ccc(c1)-c1ccccc1)cccc2)(=O)=O
SPLASH splash10-0ff0-0093000000-8dcd87dca6ac6f47191a
Source of Spectrum A1-16-2538/SMS4-3e
Wiley ID 1749505