Debug Info

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HhIw6nM4byn
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(2S)-2-amino-3-(1,3-benzodioxol-5-yl)propanoic acid ethyl ester
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(2S)-2-amino-3-(1,3-benzodioxol-5-yl)propanoic acid ethyl ester
SpectraBase Compound ID HhIw6nM4byn
InChI InChI=1S/C12H15NO4/c1-2-15-12(14)9(13)5-8-3-4-10-11(6-8)17-7-16-10/h3-4,6,9H,2,5,7,13H2,1H3/t9-/m0/s1
InChIKey SFECXIDBVMPFAI-VIFPVBQESA-N
Mol Weight 237.25 g/mol
Molecular Formula C12H15NO4
Exact Mass 237.100108 g/mol
Enantiomer InChIKey SFECXIDBVMPFAI-SECBINFHSA-N
Racemate InChIKey SFECXIDBVMPFAI-UHFFFAOYSA-N
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  • Ethyl (2S)-2-amino-3-(1,3-benzodioxol-5-yl)propanoate
  • Ethyl (2S)-2-azanyl-3-(1,3-benzodioxol-5-yl)propanoate
  • (2S)-2-amino-3-(1,3-benzodioxol-5-yl)propionic acid ethyl ester

This compound is available in the following databases:

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Wiley Registry of Mass Spectral Data 2023

Author: Wiley

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