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Benzyl [[3'-(trifluoromethyl)phenyl]thio}-acetate
SpectraBase Compound ID 1bEKXltUo3K
InChI InChI=1S/C16H13F3O2S/c17-16(18,19)13-7-4-8-14(9-13)22-11-15(20)21-10-12-5-2-1-3-6-12/h1-9H,10-11H2
InChIKey JTSNVBIRMNLXFP-UHFFFAOYSA-N
Mol Weight 326.33 g/mol
Molecular Formula C16H13F3O2S
Exact Mass 326.058835 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FPNIqOkUmuL
Name Benzyl [[3'-(trifluoromethyl)phenyl]thio}-acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13F3O2S
InChI InChI=1S/C16H13F3O2S/c17-16(18,19)13-7-4-8-14(9-13)22-11-15(20)21-10-12-5-2-1-3-6-12/h1-9H,10-11H2
InChIKey JTSNVBIRMNLXFP-UHFFFAOYSA-N
Molecular Weight 326.333 g/mol
SMILES C(c1cc(SCC(=O)OCc2ccccc2)ccc1)(F)(F)F
SPLASH splash10-0006-9401000000-a352654b93ba39b6a1b5
Source of Spectrum H-85-4295-11
Synonyms Benzyl [3'-(trifluoromethyl)phenylthio]-acetate benzyl {[3-(trifluoromethyl)phenyl]sulfanyl}acetate
Wiley ID 1525158