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6-{5-[2-(2-Naphth-2-yl-2-oxoethoxy)phenyl]-1,2,4-dithiazol-3-ylidene}-2,4-cyclohexadien-1-one
SpectraBase Compound ID AQzxpo4tTbO
InChI InChI=1S/C26H17NO3S2/c28-22-11-5-3-9-20(22)25-27-26(32-31-25)21-10-4-6-12-24(21)30-16-23(29)19-14-13-17-7-1-2-8-18(17)15-19/h1-15H,16H2/b25-20-
InChIKey PHEUBOJNPMEHCQ-QQTULTPQSA-N
Mol Weight 455.55 g/mol
Molecular Formula C26H17NO3S2
Exact Mass 455.064986 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FV3ij8aXLiJ
Name 6-{5-[2-(2-Naphth-2-yl-2-oxoethoxy)phenyl]-1,2,4-dithiazol-3-ylidene}-2,4-cyclohexadien-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H17NO3S2
InChI InChI=1S/C26H17NO3S2/c28-22-11-5-3-9-20(22)25-27-26(32-31-25)21-10-4-6-12-24(21)30-16-23(29)19-14-13-17-7-1-2-8-18(17)15-19/h1-15H,16H2/b25-20-
InChIKey PHEUBOJNPMEHCQ-QQTULTPQSA-N
Molecular Weight 455.546 g/mol
SMILES C1(C=CC=C\C1=C/1SSC(=N1)c1c(cccc1)OCC(=O)c1cc2c(cc1)cccc2)=O
SPLASH splash10-052r-0793000000-1ac26f721f0daf09867a
Source of Spectrum O1-65-1301-3
Synonyms (6Z)-6-(5-{2-[2-(2-naphthyl)-2-oxoethoxy]phenyl}-3H-1,2,4-dithiazol-3-ylidene)-2,4-cyclohexadien-1-one
Wiley ID 1593140