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Benzoic acid, 4-[(2,4-dihydroxy-6-methylbenzoyl)oxy]-2-hydroxy-3,6-dimethyl-, methyl ester
SpectraBase Compound ID GQ7MNsSY0CE
InChI InChI=1S/C18H18O7/c1-8-5-11(19)7-12(20)14(8)18(23)25-13-6-9(2)15(17(22)24-4)16(21)10(13)3/h5-7,19-21H,1-4H3
InChIKey NVVOMYVYWQDIFF-UHFFFAOYSA-N
Mol Weight 346.34 g/mol
Molecular Formula C18H18O7
Exact Mass 346.105253 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BGbp0YxubNU
Name Benzoic acid, 4-[(2,4-dihydroxy-6-methylbenzoyl)oxy]-2-hydroxy-3,6-dimethyl-, methyl ester
CAS Registry Number 70342-23-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18O7
InChI InChI=1S/C18H18O7/c1-8-5-11(19)7-12(20)14(8)18(23)25-13-6-9(2)15(17(22)24-4)16(21)10(13)3/h5-7,19-21H,1-4H3
InChIKey NVVOMYVYWQDIFF-UHFFFAOYSA-N
Molecular Weight 346.335 g/mol
SMILES Oc1cc(c(c(c1)O)C(Oc1cc(c(c(c1C)O)C(=O)OC)C)=O)C
SPLASH splash10-0w4s-3900000000-21de07f86f1c8cc3d562
Source of Spectrum H-62-717-0
Synonyms Methyl 3'-methyllecanorate Methyl 4-[(2,4-dihydroxy-6-methylbenzoyl)oxy]-2-hydroxy-3,6-dimethylbenzoate
Wiley ID 1339154