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But-1-yn-3-yl .alpha.-[1-(9-anthryl)-2,2,2-trifluoroethoxy]acetate
SpectraBase Compound ID IbkmVOm2g6D
InChI InChI=1S/C22H17F3O3/c1-3-14(2)28-19(26)13-27-21(22(23,24)25)20-17-10-6-4-8-15(17)12-16-9-5-7-11-18(16)20/h1,4-12,14,21H,13H2,2H3
InChIKey XYOJKQCCCIEHES-UHFFFAOYSA-N
Mol Weight 386.37 g/mol
Molecular Formula C22H17F3O3
Exact Mass 386.112979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D1kF6oA34PB
Name But-1-yn-3-yl .alpha.-[1-(9-anthryl)-2,2,2-trifluoroethoxy]acetate
Alternate Name(s) 1-Methyl-2-propynyl[1-(9-anthryl)-2,2,2-trifluoroethoxy]acetate
CAS Registry Number 77507-32-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H17F3O3
InChI InChI=1S/C22H17F3O3/c1-3-14(2)28-19(26)13-27-21(22(23,24)25)20-17-10-6-4-8-15(17)12-16-9-5-7-11-18(16)20/h1,4-12,14,21H,13H2,2H3
InChIKey XYOJKQCCCIEHES-UHFFFAOYSA-N
Molecular Weight 386.370 g/mol
SMILES c1(C(C(F)(F)F)OCC(OC(C#C)C)=O)c2c(cccc2)cc2c1cccc2
SPLASH splash10-0ab9-9232000000-f47c913f3ff332399f0f
Source of Spectrum J-46-3244-0
Wiley ID 1362672