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3-[5-(aminomethyl)-4-(2-keto-2-methoxy-ethyl)-3-furyl]propionic acid methyl ester
SpectraBase Compound ID 2Ke9OdAIHkH
InChI InChI=1S/C12H17NO5/c1-16-11(14)4-3-8-7-18-10(6-13)9(8)5-12(15)17-2/h7H,3-6,13H2,1-2H3
InChIKey GNPANXYTMICZCV-UHFFFAOYSA-N
Mol Weight 255.27 g/mol
Molecular Formula C12H17NO5
Exact Mass 255.110673 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4KtC9MW2Jtx
Name 3-[5-(aminomethyl)-4-(2-keto-2-methoxy-ethyl)-3-furyl]propionic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17NO5
InChI InChI=1S/C12H17NO5/c1-16-11(14)4-3-8-7-18-10(6-13)9(8)5-12(15)17-2/h7H,3-6,13H2,1-2H3
InChIKey GNPANXYTMICZCV-UHFFFAOYSA-N
Molecular Weight 255.270 g/mol
SMILES NCc1c(c(co1)CCC(=O)OC)CC(=O)OC
SPLASH splash10-00di-3590000000-f6076ffcce4914db3756
Source of Spectrum F-49-8209-24
Synonyms 3-[5-(aminomethyl)-4-(2-methoxy-2-oxoethyl)-3-furanyl]propanoic acid methyl ester Methyl 3-[5-(aminomethyl)-4-(2-methoxy-2-oxidanylidene-ethyl)furan-3-yl]propanoate Methyl 3-[5-(aminomethyl)-4-(2-methoxy-2-oxo-ethyl)-3-furyl]propanoate Methyl 3-[5-(aminomethyl)-4-(2-methoxy-2-oxoethyl)furan-3-yl]propanoate
Wiley ID 788227