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Benzoic acid, 2-hydroxy-4-[5-hydroxy-2-(methoxycarbonyl)-3-methylphenoxy]-6-methyl-, methyl ester
SpectraBase Compound ID LhUW1VznQdF
InChI InChI=1S/C18H18O7/c1-9-5-11(19)7-14(16(9)18(22)24-4)25-12-6-10(2)15(13(20)8-12)17(21)23-3/h5-8,19-20H,1-4H3
InChIKey GAOYXJDCUCTGGR-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 2mdk7mVzYIV
Name Benzoic acid, 2-hydroxy-4-[5-hydroxy-2-(methoxycarbonyl)-3-methylphenoxy]-6-methyl-, methyl ester
CAS Registry Number 111699-22-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18O7
InChI InChI=1S/C18H18O7/c1-9-5-11(19)7-14(16(9)18(22)24-4)25-12-6-10(2)15(13(20)8-12)17(21)23-3/h5-8,19-20H,1-4H3
InChIKey GAOYXJDCUCTGGR-UHFFFAOYSA-N
Molecular Weight 346.335 g/mol
SMILES Oc1cc(Oc2c(c(cc(c2)O)C)C(=O)OC)cc(c1C(=O)OC)C
SPLASH splash10-0a4i-0098000000-dc6c5a8730b60a162fdf
Source of Spectrum B-40-190-13
Synonyms Methyl 4-hydroxy-2-(3'-hydroxy-4'-methoxycarbonyl-5'-methylphenoxy)-6-methylbenzoate Methyl 4-hydroxy-2-[3-hydroxy-4-(methoxycarbonyl)-5-methylphenoxy]-6-methylbenzoate
Wiley ID 1339157