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2-Malonamoylphenylacetic acid
SpectraBase Compound ID 227NDPWS5Pf
InChI InChI=1S/C11H11NO4/c12-10(14)6-9(13)8-4-2-1-3-7(8)5-11(15)16/h1-4H,5-6H2,(H2,12,14)(H,15,16)
InChIKey WDXXHJZBSFDXKF-UHFFFAOYSA-N
Mol Weight 221.21 g/mol
Molecular Formula C11H11NO4
Exact Mass 221.068808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1m8qUqsRVBz
Name 2-Malonamoylphenylacetic acid
CAS Registry Number 89462-33-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11NO4
InChI InChI=1S/C11H11NO4/c12-10(14)6-9(13)8-4-2-1-3-7(8)5-11(15)16/h1-4H,5-6H2,(H2,12,14)(H,15,16)
InChIKey WDXXHJZBSFDXKF-UHFFFAOYSA-N
Molecular Weight 221.212 g/mol
SMILES NC(CC(c1c(CC(=O)O)cccc1)=O)=O
SPLASH splash10-014l-4920000000-b87d2a2801e7720a3d18
Source of Spectrum J-49-2017-0
Synonyms [2-(3-amino-3-oxopropanoyl)phenyl]acetic acid 2-[2-(3-amino-1,3-dioxopropyl)phenyl]acetic acid 2-[2-(3-amino-3-oxopropanoyl)phenyl]acetic acid 2-[2-(3-amino-3-oxo-propanoyl)phenyl]acetic acid 2-[2-(3-azanyl-3-oxidanylidene-propanoyl)phenyl]ethanoic acid
Wiley ID 1221131