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Methyl 5-(3',5'-dihydroxyphenyl)-2(R,S)-methylpentanoate

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Methyl 5-(3',5'-dihydroxyphenyl)-2(R,S)-methylpentanoate
SpectraBase Compound ID HQizNyIY8ht
InChI InChI=1S/C13H18O4/c1-9(13(16)17-2)4-3-5-10-6-11(14)8-12(15)7-10/h6-9,14-15H,3-5H2,1-2H3
InChIKey FILGNIMFJUZNTF-UHFFFAOYSA-N
Mol Weight 238.28 g/mol
Molecular Formula C13H18O4
Exact Mass 238.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FOQhSIj0BnS
Name Methyl 5-(3',5'-dihydroxyphenyl)-2(R,S)-methylpentanoate
Alternate Name(s) Methyl 5-(3,5-dihydroxyphenyl)-2-methylpentanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O4
InChI InChI=1S/C13H18O4/c1-9(13(16)17-2)4-3-5-10-6-11(14)8-12(15)7-10/h6-9,14-15H,3-5H2,1-2H3
InChIKey FILGNIMFJUZNTF-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.19800630845
Molecular Weight 238.283 g/mol
SMILES Oc1cc(cc(c1)O)CCCC(C(=O)OC)C
SPLASH splash10-00di-0920000000-9d1d350ffc7186f6483c
Source of Spectrum H-63-2514-19
Wiley ID 1797537