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[[3-(4-Bromophenyl)-3-oxopropyl](methyl)amino]acetic acid
SpectraBase Compound ID GlLBW7MNqIr
InChI InChI=1S/C12H14BrNO3/c1-14(8-12(16)17)7-6-11(15)9-2-4-10(13)5-3-9/h2-5H,6-8H2,1H3,(H,16,17)
InChIKey BLGTZFFBZAVEEA-UHFFFAOYSA-N
Mol Weight 300.15 g/mol
Molecular Formula C12H14BrNO3
Exact Mass 299.015706 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BWOLnHHkIML
Name [[3-(4-Bromophenyl)-3-oxopropyl](methyl)amino]acetic acid
CAS Registry Number 327098-01-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14BrNO3
InChI InChI=1S/C12H14BrNO3/c1-14(8-12(16)17)7-6-11(15)9-2-4-10(13)5-3-9/h2-5H,6-8H2,1H3,(H,16,17)
InChIKey BLGTZFFBZAVEEA-UHFFFAOYSA-N
Molecular Weight 300.152 g/mol
SMILES OC(CN(CCC(c1ccc(cc1)Br)=O)C)=O
SPLASH splash10-0006-9610000000-dc7a74b8cbfdc8c0a022
Synonyms 2-[[3-(4-bromophenyl)-3-keto-propyl]-methyl-amino]acetic acid 2-[[3-(4-bromophenyl)-3-keto-propyl]-methyl-ammonio]acetate 2-[[3-(4-bromophenyl)-3-oxidanylidene-propyl]-methyl-amino]ethanoic acid 2-[[3-(4-bromophenyl)-3-oxidanylidene-propyl]-methyl-azaniumyl]ethanoate 2-[[3-(4-bromophenyl)-3-oxo-propyl]-methyl-amino]acetic acid 2-[[3-(4-bromophenyl)-3-oxo-propyl]-methyl-ammonio]acetate 2-[[3-(4-bromophenyl)-3-oxopropyl]-methylazaniumyl]acetate Acetic acid, 2-[3-(4-bromophenyl)-3-oxopropyl](methyl)amino-
Wiley ID 1457234