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Benzyl .alpha.-[1-(9-anthryl)-2,2,2-trifluoroethoxy]thioacetate
SpectraBase Compound ID FixmBPrqNJ9
InChI InChI=1S/C25H19F3O2S/c26-25(27,28)24(30-16-22(31)29-15-17-8-2-1-3-9-17)23-20-12-6-4-10-18(20)14-19-11-5-7-13-21(19)23/h1-14,24H,15-16H2
InChIKey HIGCTSYGXZAUNL-UHFFFAOYSA-N
Mol Weight 440.48 g/mol
Molecular Formula C25H19F3O2S
Exact Mass 440.105786 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 37MVY2kBX3F
Name Benzyl .alpha.-[1-(9-anthryl)-2,2,2-trifluoroethoxy]thioacetate
Alternate Name(s) O-benzyl[1-(9-anthryl)-2,2,2-trifluoroethoxy]ethanethioate
CAS Registry Number 77507-49-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H19F3O2S
InChI InChI=1S/C25H19F3O2S/c26-25(27,28)24(30-16-22(31)29-15-17-8-2-1-3-9-17)23-20-12-6-4-10-18(20)14-19-11-5-7-13-21(19)23/h1-14,24H,15-16H2
InChIKey HIGCTSYGXZAUNL-UHFFFAOYSA-N
Molecular Weight 440.480 g/mol
SMILES c1(C(C(F)(F)F)OCC(=S)OCc2ccccc2)c2c(cccc2)cc2c1cccc2
SPLASH splash10-0006-5291500000-775f2eaf4832d1039f1e
Source of Spectrum J-46-3245-0
Wiley ID 1384708