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1-(Methoxycarbonyl)ethyl .alpha.-[1-(9-anthryl)-2,2,2-trifluoroethoxy]thioacetate
SpectraBase Compound ID 14zSpOyXPjI
InChI InChI=1S/C22H19F3O4S/c1-13(21(26)27-2)29-18(30)12-28-20(22(23,24)25)19-16-9-5-3-7-14(16)11-15-8-4-6-10-17(15)19/h3-11,13,20H,12H2,1-2H3
InChIKey UAPCIFLNDIVXPF-UHFFFAOYSA-N
Mol Weight 436.45 g/mol
Molecular Formula C22H19F3O4S
Exact Mass 436.095615 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LDv00ymu1my
Name 1-(Methoxycarbonyl)ethyl .alpha.-[1-(9-anthryl)-2,2,2-trifluoroethoxy]thioacetate
CAS Registry Number 77507-47-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H19F3O4S
InChI InChI=1S/C22H19F3O4S/c1-13(21(26)27-2)29-18(30)12-28-20(22(23,24)25)19-16-9-5-3-7-14(16)11-15-8-4-6-10-17(15)19/h3-11,13,20H,12H2,1-2H3
InChIKey UAPCIFLNDIVXPF-UHFFFAOYSA-N
Molecular Weight 436.445 g/mol
SMILES c1(C(C(F)(F)F)OCC(OC(C(=O)OC)C)=S)c2c(cccc2)cc2c1cccc2
SPLASH splash10-05r0-1900000000-cfe6d48cd75084583ef1
Source of Spectrum J-46-3245-0
Synonyms Methyl 2-({2-[1-(9-anthryl)-2,2,2-trifluoroethoxy]ethanethioyl}oxy)propanoate
Wiley ID 1383437