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N-Chloroacetyl p-Aminomethylbenzoic Acid
SpectraBase Compound ID LGmbWLDWhXn
InChI InChI=1S/C10H10ClNO3/c11-5-9(13)12-6-7-1-3-8(4-2-7)10(14)15/h1-4H,5-6H2,(H,12,13)(H,14,15)
InChIKey VZLSDUUGXHOISG-UHFFFAOYSA-N
Mol Weight 227.65 g/mol
Molecular Formula C10H10ClNO3
Exact Mass 227.034921 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID xfL2OlceMA
Name N-Chloroacetyl p-Aminomethylbenzoic Acid
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10ClNO3
InChI InChI=1S/C10H10ClNO3/c11-5-9(13)12-6-7-1-3-8(4-2-7)10(14)15/h1-4H,5-6H2,(H,12,13)(H,14,15)
InChIKey VZLSDUUGXHOISG-UHFFFAOYSA-N
Instrument Name Finnigan MAT 8200
Ionization Type EI
Literature Reference DOI 10.1021/acs.jmedchem.5b00621
Molecular Weight 227.647 g/mol
Reported Formula C10H10ClNO3
SMILES N(C(CCl)=O)Cc1ccc(C(=O)O)cc1
SPLASH splash10-0006-0910000000-d7b68672f3c7b6cb56ca
Source of Spectrum AF-58-6527-11c
Wiley ID 1865502