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GYROPHORIC-ACID
SpectraBase Compound ID CjxrDUHrCVw
InChI InChI=1S/C24H20O10/c1-10-4-13(25)7-16(26)20(10)23(31)34-15-6-12(3)21(18(28)9-15)24(32)33-14-5-11(2)19(22(29)30)17(27)8-14/h4-9,25-28H,1-3H3,(H,29,30)
InChIKey ATQPZSQVWCPVGV-UHFFFAOYSA-N
Mol Weight 468.41 g/mol
Molecular Formula C24H20O10
Exact Mass 468.105647 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 16qsGhBsNCn
Name 2-Methyl-4-[2-methyl-4-[2-methyl-4,6-bis(oxidanyl)phenyl]carbonyloxy-6-oxidanyl-phenyl]carbonyloxy-6-oxidanyl-benzoic acid
CAS Registry Number 548-89-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H20O10
InChI InChI=1S/C24H20O10/c1-10-4-13(25)7-16(26)20(10)23(31)34-15-6-12(3)21(18(28)9-15)24(32)33-14-5-11(2)19(22(29)30)17(27)8-14/h4-9,25-28H,1-3H3,(H,29,30)
InChIKey ATQPZSQVWCPVGV-UHFFFAOYSA-N
Molecular Weight 468.414 g/mol
SMILES Oc1cc(OC(c2c(cc(cc2C)OC(c2c(cc(cc2C)O)O)=O)O)=O)cc(c1C(=O)O)C
SPLASH splash10-0fk9-6900000000-ef761ff9194f8ce598ed
Source of Spectrum B-29-1085-0
Synonyms 4-({4-[(2,4-dihydroxy-6-methylbenzoyl)oxy]-2-hydroxy-6-methylbenzoyl}oxy)-2-hydroxy-6-methylbenzoic acid 4-[[4-[(2,4-dihydroxy-6-methylphenyl)-oxomethoxy]-2-hydroxy-6-methylphenyl]-oxomethoxy]-2-hydroxy-6-methylbenzoic acid Gyrophoric acid 4-[4-(2,4-dihydroxy-6-methylbenzoyl)oxy-2-hydroxy-6-methylbenzoyl]oxy-2-hydroxy-6-methylbenzoic acid
Wiley ID 1392357