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3-(Benzo[d][1,3]dioxol-4-yl(methyl)amino)-3-oxopropanoic Acid
SpectraBase Compound ID AYNI0WXoZhH
InChI InChI=1S/C11H11NO5/c1-12(9(13)5-10(14)15)7-3-2-4-8-11(7)17-6-16-8/h2-4H,5-6H2,1H3,(H,14,15)
InChIKey VGVUHLGCKIZBSF-UHFFFAOYSA-N
Mol Weight 237.21 g/mol
Molecular Formula C11H11NO5
Exact Mass 237.063722 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID hQXtSd6B82
Name 3-(Benzo[d][1,3]dioxol-4-yl(methyl)amino)-3-oxopropanoic Acid
Appearance Colorless solid
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Formula C11H11NO5
InChI InChI=1S/C11H11NO5/c1-12(9(13)5-10(14)15)7-3-2-4-8-11(7)17-6-16-8/h2-4H,5-6H2,1H3,(H,14,15)
InChIKey VGVUHLGCKIZBSF-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1021/jm801335z
Molecular Weight 237.211 g/mol
Reported Formula C11H11NO5
SMILES OC(CC(N(c1cccc2c1OCO2)C)=O)=O
SPLASH splash10-0udl-6920000000-d5a4f9098359a4c6254f
Source of Spectrum AF-52-1880-2
Wiley ID 1873808