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(Z)-1-(4-Methoxybenzylidene)-3-(trifluoromethyl)-1H-isothiochromene

View entire compound with spectra: 1 MS (GC)

(Z)-1-(4-Methoxybenzylidene)-3-(trifluoromethyl)-1H-isothiochromene
SpectraBase Compound ID Dn7mBPpxVPA
InChI InChI=1S/C18H13F3OS/c1-22-14-8-6-12(7-9-14)10-16-15-5-3-2-4-13(15)11-17(23-16)18(19,20)21/h2-11H,1H3/b16-10-
InChIKey QMOKHQSHIKIYMZ-YBEGLDIGSA-N
Mol Weight 334.36 g/mol
Molecular Formula C18H13F3OS
Exact Mass 334.063921 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GygRmV4kPFV
Name (Z)-1-(4-Methoxybenzylidene)-3-(trifluoromethyl)-1H-isothiochromene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13F3OS
InChI InChI=1S/C18H13F3OS/c1-22-14-8-6-12(7-9-14)10-16-15-5-3-2-4-13(15)11-17(23-16)18(19,20)21/h2-11H,1H3/b16-10-
InChIKey QMOKHQSHIKIYMZ-YBEGLDIGSA-N
Molecular Weight 334.356 g/mol
SMILES C=1(S\C(c2c(C1)cccc2)=C\c1ccc(cc1)OC)C(F)(F)F
SPLASH splash10-0006-0019000000-aca434b252b42c842cca
Source of Spectrum F4-44-969-2e
Wiley ID 1706978