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DIFFRACTAINSAEURE
SpectraBase Compound ID CVJecoJUanX
InChI InChI=1S/C20H22O7/c1-9-8-14(11(3)17(21)15(9)19(22)23)27-20(24)16-10(2)7-13(25-5)12(4)18(16)26-6/h7-8,21H,1-6H3,(H,22,23)
InChIKey MIJKZXWOOXIEEU-UHFFFAOYSA-N
Mol Weight 374.39 g/mol
Molecular Formula C20H22O7
Exact Mass 374.136553 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Br6JBc4ktwf
Name Benzoic acid, 2,4-dimethoxy-3,6-dimethyl-, 4-carboxy-3-hydroxy-2,5-dimethylphenyl ester
Alternate Name(s) 4-(2,4-dimethoxy-3,6-dimethyl-phenyl)carbonyloxy-3,6-dimethyl-2-oxidanyl-benzoic acid 4-[(2,4-dimethoxy-3,6-dimethylbenzoyl)oxy]-2-hydroxy-3,6-dimethylbenzoic acid 4-[(2,4-dimethoxy-3,6-dimethylphenyl)-oxomethoxy]-2-hydroxy-3,6-dimethylbenzoic acid Diffractaic acid Diffractanic acid Diffractic acid Diffractoic acid Dirbizomic acid Dirhizomic acid 4-(2,4-dimethoxy-3,6-dimethylbenzoyl)oxy-2-hydroxy-3,6-dimethylbenzoic acid BRN 2915070 NSC 5901
CAS Registry Number 436-32-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22O7
InChI InChI=1S/C20H22O7/c1-9-8-14(11(3)17(21)15(9)19(22)23)27-20(24)16-10(2)7-13(25-5)12(4)18(16)26-6/h7-8,21H,1-6H3,(H,22,23)
InChIKey MIJKZXWOOXIEEU-UHFFFAOYSA-N
Molecular Weight 374.389 g/mol
SMILES OC(c1c(cc(c(c1O)C)OC(=O)c1c(OC)c(C)c(OC)cc1C)C)=O
SPLASH splash10-0006-1900000000-60a11bb3fb8b000b5882
Source of Spectrum B-28-1123-0
Wiley ID 1356587