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3-[2-hydroxy-4-(methoxymethoxy)phenyl]propanoic acid ethyl ester
SpectraBase Compound ID 4S2IkXN07b4
InChI InChI=1S/C13H18O5/c1-3-17-13(15)7-5-10-4-6-11(8-12(10)14)18-9-16-2/h4,6,8,14H,3,5,7,9H2,1-2H3
InChIKey KWJKKVIOXDVLFW-UHFFFAOYSA-N
Mol Weight 254.28 g/mol
Molecular Formula C13H18O5
Exact Mass 254.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1cnXmoctH9U
Name 3-[2-hydroxy-4-(methoxymethoxy)phenyl]propanoic acid ethyl ester
Alternate Name(s) 3-[2-hydroxy-4-(methoxymethoxy)phenyl]propionic acid ethyl ester ethyl 3-[4-(methoxymethoxy)-2-oxidanyl-phenyl]propanoate
CAS Registry Number 80754-22-9
Comments Less than 3 mono-isotopic peaks
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Formula C13H18O5
InChI InChI=1S/C13H18O5/c1-3-17-13(15)7-5-10-4-6-11(8-12(10)14)18-9-16-2/h4,6,8,14H,3,5,7,9H2,1-2H3
InChIKey KWJKKVIOXDVLFW-UHFFFAOYSA-N
Molecular Weight 254.282 g/mol
SMILES Oc1cc(OCOC)ccc1CCC(=O)OCC
SPLASH splash10-014i-0940000000-36a96815845eb93acfa0
Source of Spectrum J-47-1529-0
Wiley ID 1257496