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1',5'-Bis(4-Carboxy-2-methoxyphenoxy)pentane
SpectraBase Compound ID 4VVwttHmUGP
InChI InChI=1S/C21H24O8/c1-26-18-12-14(20(22)23)6-8-16(18)28-10-4-3-5-11-29-17-9-7-15(21(24)25)13-19(17)27-2/h6-9,12-13H,3-5,10-11H2,1-2H3,(H,22,23)(H,24,25)
InChIKey RPOCJYVWIAWHQF-UHFFFAOYSA-N
Mol Weight 404.42 g/mol
Molecular Formula C21H24O8
Exact Mass 404.147118 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2AxZbQlc2LU
Name 1',5'-Bis(4-Carboxy-2-methoxyphenoxy)pentane
Alternate Name(s) 4-{[5-(4-carboxy-2-methoxyphenoxy)pentyl]oxy}-3-methoxybenzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24O8
InChI InChI=1S/C21H24O8/c1-26-18-12-14(20(22)23)6-8-16(18)28-10-4-3-5-11-29-17-9-7-15(21(24)25)13-19(17)27-2/h6-9,12-13H,3-5,10-11H2,1-2H3,(H,22,23)(H,24,25)
InChIKey RPOCJYVWIAWHQF-UHFFFAOYSA-N
Molecular Weight 404.415 g/mol
SMILES OC(c1cc(c(OCCCCCOc2c(cc(C(=O)O)cc2)OC)cc1)OC)=O
SPLASH splash10-00kf-9010000000-6a69b2ca9c5aebef4569
Source of Spectrum J-61-8144-6
Wiley ID 1371209