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4-[4-(4-carboxy-2-methoxy-phenoxy)butoxy]-3-methoxy-benzoic acid

View entire compound with spectra: 1 MS (GC)

4-[4-(4-carboxy-2-methoxy-phenoxy)butoxy]-3-methoxy-benzoic acid
SpectraBase Compound ID 6ZmuIR1p1a0
InChI InChI=1S/C20H22O8/c1-25-17-11-13(19(21)22)5-7-15(17)27-9-3-4-10-28-16-8-6-14(20(23)24)12-18(16)26-2/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,21,22)(H,23,24)
InChIKey XTRCWKFJYCOFNN-UHFFFAOYSA-N
Mol Weight 390.39 g/mol
Molecular Formula C20H22O8
Exact Mass 390.131468 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DNa46ZJkPbV
Name 4-[4-(4-carboxy-2-methoxy-phenoxy)butoxy]-3-methoxy-benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22O8
InChI InChI=1S/C20H22O8/c1-25-17-11-13(19(21)22)5-7-15(17)27-9-3-4-10-28-16-8-6-14(20(23)24)12-18(16)26-2/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,21,22)(H,23,24)
InChIKey XTRCWKFJYCOFNN-UHFFFAOYSA-N
Molecular Weight 390.388 g/mol
SMILES OC(c1cc(c(OCCCCOc2c(cc(C(=O)O)cc2)OC)cc1)OC)=O
SPLASH splash10-05gi-9881000000-5bf0365d20025755def7
Source of Spectrum J-61-8144-6
Wiley ID 1364721