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[2S]-(+)-2-(3,4-Methylenedioxyphenyl)-3-(4-methoxyphenyloxy)propanoic acid
SpectraBase Compound ID 4k7P5PBizu7
InChI InChI=1S/C17H16O6/c1-20-12-3-5-13(6-4-12)21-9-14(17(18)19)11-2-7-15-16(8-11)23-10-22-15/h2-8,14H,9-10H2,1H3,(H,18,19)/t14-/m1/s1
InChIKey FWPZHACSWRSJFD-CQSZACIVSA-N
Mol Weight 316.31 g/mol
Molecular Formula C17H16O6
Exact Mass 316.094688 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AWODgezdhvo
Name [2S]-(+)-2-(3,4-Methylenedioxyphenyl)-3-(4-methoxyphenyloxy)propanoic acid
Alternate Name(s) (2S)-2-(1,3-benzodioxol-5-yl)-3-(4-methoxyphenoxy)propanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16O6
InChI InChI=1S/C17H16O6/c1-20-12-3-5-13(6-4-12)21-9-14(17(18)19)11-2-7-15-16(8-11)23-10-22-15/h2-8,14H,9-10H2,1H3,(H,18,19)/t14-/m1/s1
InChIKey FWPZHACSWRSJFD-CQSZACIVSA-N
Molecular Weight 316.309 g/mol
SMILES OC([C@](COc1ccc(cc1)OC)(c1cc2c(cc1)OCO2)[H])=O
SPLASH splash10-004i-3920000000-11567c739a072aaf2309
Source of Spectrum KD-14-493-3
Wiley ID 1635830