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1-Acetoxy-2,6-Bis(acetoxymethyl)-4-(2-phenyl-1-ethynyl)benzene
SpectraBase Compound ID ELhDYgoT2Jl
InChI InChI=1S/C22H20O6/c1-15(23)26-13-20-11-19(10-9-18-7-5-4-6-8-18)12-21(14-27-16(2)24)22(20)28-17(3)25/h4-8,11-12H,13-14H2,1-3H3
InChIKey BTNSZSCCAVVNPB-UHFFFAOYSA-N
Mol Weight 380.4 g/mol
Molecular Formula C22H20O6
Exact Mass 380.125988 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID aLuwAyo7e7
Name 1-Acetoxy-2,6-Bis(acetoxymethyl)-4-(2-phenyl-1-ethynyl)benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H20O6
InChI InChI=1S/C22H20O6/c1-15(23)26-13-20-11-19(10-9-18-7-5-4-6-8-18)12-21(14-27-16(2)24)22(20)28-17(3)25/h4-8,11-12H,13-14H2,1-3H3
InChIKey BTNSZSCCAVVNPB-UHFFFAOYSA-N
Molecular Weight 380.396 g/mol
SMILES c1(c(cc(C#Cc2ccccc2)cc1COC(=O)C)COC(=O)C)OC(=O)C
SPLASH splash10-002r-0092000000-f322539552a54e8774c8
Source of Spectrum F-56-413-26
Synonyms 2-(acetyloxy)-3-[(acetyloxy)methyl]-5-(phenylethynyl)benzyl acetate
Wiley ID 855522