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(Z)-4-(2-(3-Benzylbenzo[d]thiazol-2(3H)-ylidene)acetyl)benzonitrile
SpectraBase Compound ID KGRKigoH3x2
InChI InChI=1S/C23H16N2OS/c24-15-17-10-12-19(13-11-17)21(26)14-23-25(16-18-6-2-1-3-7-18)20-8-4-5-9-22(20)27-23/h1-14H,16H2/b23-14-
InChIKey JZOSDJPAEBYVIS-UCQKPKSFSA-N
Mol Weight 368.45 g/mol
Molecular Formula C23H16N2OS
Exact Mass 368.098334 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3RfaeVUegOO
Name (Z)-4-(2-(3-Benzylbenzo[d]thiazol-2(3H)-ylidene)acetyl)benzonitrile
Appearance Orange solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H16N2OS
InChI InChI=1S/C23H16N2OS/c24-15-17-10-12-19(13-11-17)21(26)14-23-25(16-18-6-2-1-3-7-18)20-8-4-5-9-22(20)27-23/h1-14H,16H2/b23-14-
InChIKey JZOSDJPAEBYVIS-UCQKPKSFSA-N
Instrument Name Finnigan MAT Triple-Quadrupol-spectrometer TSQ 7000
Ionization Type EI positive ion
Literature Reference DOI 10.1002/anie.201916396
Molecular Weight 368.454 g/mol
SMILES c1cc(ccc1C#N)C(=O)\C=C/1Sc2c(N1Cc1ccccc1)cccc2
SPLASH splash10-0006-9161000000-99d068baabda73f04e98
Source of Spectrum ACI-59-SM53-3ac
Thin-Layer Chromatography Rf = 0.08 (n-hexane/acetone, 4:1)
Wiley ID 1857987