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2'-O-methyllecanoric acid
SpectraBase Compound ID GtWb9GYKz1v
InChI InChI=1S/C17H16O7/c1-8-4-10(18)6-12(19)14(8)17(22)24-11-5-9(2)15(16(20)21)13(7-11)23-3/h4-7,18-19H,1-3H3,(H,20,21)
InChIKey UTRDBWSXSQQDOY-UHFFFAOYSA-N
Mol Weight 332.31 g/mol
Molecular Formula C17H16O7
Exact Mass 332.089603 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ElniMLGiHJV
Name 2'-O-methyllecanoric acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16O7
InChI InChI=1S/C17H16O7/c1-8-4-10(18)6-12(19)14(8)17(22)24-11-5-9(2)15(16(20)21)13(7-11)23-3/h4-7,18-19H,1-3H3,(H,20,21)
InChIKey UTRDBWSXSQQDOY-UHFFFAOYSA-N
Molecular Weight 332.308 g/mol
SMILES OC(c1c(cc(OC(c2c(cc(cc2C)O)O)=O)cc1C)OC)=O
SPLASH splash10-03yi-0900000000-183817e766e93ead3551
Source of Spectrum B-48-1761-0
Synonyms 4-[(2,4-dihydroxy-6-methylbenzoyl)oxy]-2-methoxy-6-methylbenzoic acid
Wiley ID 1329266