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ISOINDOLO-[1,2-B]-BENZOTHIAZOLE-11-ONE

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ISOINDOLO-[1,2-B]-BENZOTHIAZOLE-11-ONE
SpectraBase Compound ID 2Ifi5Vv1z1m
InChI InChI=1S/C27H23NOS/c29-26-24-21-16-18(15-20(21)17-9-3-1-4-10-17)25(24)27(19-11-5-2-6-12-19)28(26)22-13-7-8-14-23(22)30-27/h1-14,18,20-21,24-25H,15-16H2/t18-,20+,21-,24+,25-,27+/m0/s1
InChIKey JWOMMCSDOXZYJT-AMMHBVSRSA-N
Mol Weight 409.55 g/mol
Molecular Formula C27H23NOS
Exact Mass 409.150036 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IPIFOeNdG3Y
Name ISOINDOLO-[1,2-B]-BENZOTHIAZOLE-11-ONE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H23NOS
InChI InChI=1S/C27H23NOS/c29-26-24-21-16-18(15-20(21)17-9-3-1-4-10-17)25(24)27(19-11-5-2-6-12-19)28(26)22-13-7-8-14-23(22)30-27/h1-14,18,20-21,24-25H,15-16H2/t18-,20+,21-,24+,25-,27+/m0/s1
InChIKey JWOMMCSDOXZYJT-AMMHBVSRSA-N
Literature Reference Author P.SOHAR,S.FRIMPONG-MANSO,G.STAJER,G.BERNATH
Literature Reference Citation MAGN.RES.CHEM.,32,705(1994)
Literature Reference DOI 10.1002/mrc.1260321202
Molecular Weight 409.546 g/mol
Solvent CDCl3
Source File Reference UWMS3002