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2,4-Dimethoxy-6-(1-methylpent-3-ynyloxycarbonylmethyl)benzoic acid
SpectraBase Compound ID CKxWhQUPlBE
InChI InChI=1S/C17H20O6/c1-5-6-7-11(2)23-15(18)9-12-8-13(21-3)10-14(22-4)16(12)17(19)20/h8,10-11H,7,9H2,1-4H3,(H,19,20)
InChIKey HLTPKGRTPZIYCV-UHFFFAOYSA-N
Mol Weight 320.34 g/mol
Molecular Formula C17H20O6
Exact Mass 320.125988 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BJhlMpZfISo
Name 2,4-Dimethoxy-6-(1-methylpent-3-ynyloxycarbonylmethyl)benzoic acid
Alternate Name(s) 2,4-Dimethoxy-6-{2-[(1-methyl-3-pentynyl)oxy]-2-oxoethyl}benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20O6
InChI InChI=1S/C17H20O6/c1-5-6-7-11(2)23-15(18)9-12-8-13(21-3)10-14(22-4)16(12)17(19)20/h8,10-11H,7,9H2,1-4H3,(H,19,20)
InChIKey HLTPKGRTPZIYCV-UHFFFAOYSA-N
Molecular Weight 320.341 g/mol
SMILES OC(c1c(cc(cc1CC(=O)OC(CC#CC)C)OC)OC)=O
SPLASH splash10-00di-1692000000-935a39d36016d5f57eb8
Source of Spectrum F-68-1526-14
Wiley ID 1571907