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(Z)-1-(4-Nitrobenzylidene)-3-(trifluoromethyl)-1H-isothiochromene
SpectraBase Compound ID D7EAJunKTWB
InChI InChI=1S/C17H10F3NO2S/c18-17(19,20)16-10-12-3-1-2-4-14(12)15(24-16)9-11-5-7-13(8-6-11)21(22)23/h1-10H/b15-9-
InChIKey FCRRAAKZYLINEF-DHDCSXOGSA-N
Mol Weight 349.33 g/mol
Molecular Formula C17H10F3NO2S
Exact Mass 349.038434 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5rPdqLFtwfA
Name (Z)-1-(4-Nitrobenzylidene)-3-(trifluoromethyl)-1H-isothiochromene
Comments Removed - expert review: column bleed
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H10F3NO2S
InChI InChI=1S/C17H10F3NO2S/c18-17(19,20)16-10-12-3-1-2-4-14(12)15(24-16)9-11-5-7-13(8-6-11)21(22)23/h1-10H/b15-9-
InChIKey FCRRAAKZYLINEF-DHDCSXOGSA-N
Molecular Weight 349.327 g/mol
SMILES C=1(S\C(c2c(C1)cccc2)=C\c1ccc(N(=O)=O)cc1)C(F)(F)F
SPLASH splash10-0532-0098000000-ec34aae66169aa7083cc
Source of Spectrum F4-44-970-2i
Wiley ID 1706975