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di-Tert-butyl 4-benzoyl-3-trifluoromethylcyclobut-2-ene-1,2-dicarboxylate
SpectraBase Compound ID 3mjI6bD30HZ
InChI InChI=1S/C22H25F3O5/c1-20(2,3)29-18(27)13-14(17(26)12-10-8-7-9-11-12)16(22(23,24)25)15(13)19(28)30-21(4,5)6/h7-11,13-14H,1-6H3
InChIKey QYMWYECEUHZYJA-UHFFFAOYSA-N
Mol Weight 426.43 g/mol
Molecular Formula C22H25F3O5
Exact Mass 426.165408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bo9jMazwzuN
Name Di-tert-Butyl 4-benzoyl-3-trifluoromethylcyclobut-2-ene-1,2-dicarboxylate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H25F3O5
InChI InChI=1S/C22H25F3O5/c1-20(2,3)29-18(27)13-14(17(26)12-10-8-7-9-11-12)16(22(23,24)25)15(13)19(28)30-21(4,5)6/h7-11,13-14H,1-6H3
InChIKey QYMWYECEUHZYJA-UHFFFAOYSA-N
Molecular Weight 426.432 g/mol
SMILES C1(C(=C(C1C(c1ccccc1)=O)C(F)(F)F)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C
SPLASH splash10-0a4i-4900000000-a205aea7648ac977bd1e
Source of Spectrum CV-2004-1032-3
Synonyms di(tert-butyl) 4-benzoyl-3-(trifluoromethyl)-2-cyclobutene-1,2-dicarboxylate
Wiley ID 1611329