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2-Acetoxy-6-methyl-benzoic acid 2,5-diacetoxy-3-acetoxymethyl-phenyl ester
SpectraBase Compound ID KKNx7TzuU0J
InChI InChI=1S/C23H22O10/c1-12-7-6-8-19(31-15(4)26)21(12)23(28)33-20-10-18(30-14(3)25)9-17(11-29-13(2)24)22(20)32-16(5)27/h6-10H,11H2,1-5H3
InChIKey TXFBICUFYOJGQR-UHFFFAOYSA-N
Mol Weight 458.42 g/mol
Molecular Formula C23H22O10
Exact Mass 458.121297 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6af1IFwXAWm
Name 2-Acetoxy-6-methyl-benzoic acid 2,5-diacetoxy-3-acetoxymethyl-phenyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H22O10
InChI InChI=1S/C23H22O10/c1-12-7-6-8-19(31-15(4)26)21(12)23(28)33-20-10-18(30-14(3)25)9-17(11-29-13(2)24)22(20)32-16(5)27/h6-10H,11H2,1-5H3
InChIKey TXFBICUFYOJGQR-UHFFFAOYSA-N
Molecular Weight 458.419 g/mol
SMILES C(c1c(OC(=O)C)cccc1C)(Oc1c(c(COC(=O)C)cc(c1)OC(=O)C)OC(=O)C)=O
SPLASH splash10-002r-0900000000-d2a05bff8ed4757347ac
Source of Spectrum X2-55-642-5
Synonyms 1,6-bis(Acetoxy)-6-[6'-methyl(o-acetyl)salicyloxy]-2-(acetoxymethyl)-2-cyclohexen-1-one 2,5-bis(acetyloxy)-3-[(acetyloxy)methyl]phenyl 2-(acetyloxy)-6-methylbenzoate
Wiley ID 1604451