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3'-hydroxy-5'-propylphenyl 2,4-dihydroxy-6-pentylbenzoate
SpectraBase Compound ID KSJouGWlGqL
InChI InChI=1S/C21H26O5/c1-3-5-6-8-15-11-17(23)13-19(24)20(15)21(25)26-18-10-14(7-4-2)9-16(22)12-18/h9-13,22-24H,3-8H2,1-2H3
InChIKey ISTWWFHRVAZARK-UHFFFAOYSA-N
Mol Weight 358.43 g/mol
Molecular Formula C21H26O5
Exact Mass 358.178024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9wovg33bX1D
Name 3'-hydroxy-5'-propylphenyl 2,4-dihydroxy-6-pentylbenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26O5
InChI InChI=1S/C21H26O5/c1-3-5-6-8-15-11-17(23)13-19(24)20(15)21(25)26-18-10-14(7-4-2)9-16(22)12-18/h9-13,22-24H,3-8H2,1-2H3
InChIKey ISTWWFHRVAZARK-UHFFFAOYSA-N
Molecular Weight 358.434 g/mol
SMILES Oc1cc(OC(c2c(cc(cc2CCCCC)O)O)=O)cc(c1)CCC
SPLASH splash10-0a4i-0890000000-b0bab9d139275a805787
Source of Spectrum JA-50-1145-0
Synonyms 3-Hydroxy-5-propylphenyl 2,4-dihydroxy-6-pentylbenzoate Decarboxy-norimbricaric acid
Wiley ID 1347199