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1-(4-Amino-3-chlorophenyl)butan-1-one
SpectraBase Compound ID KdQs7XpBWz0
InChI InChI=1S/C10H12ClNO/c1-2-3-10(13)7-4-5-9(12)8(11)6-7/h4-6H,2-3,12H2,1H3
InChIKey AMBKVHMGXICXJT-UHFFFAOYSA-N
Mol Weight 197.66 g/mol
Molecular Formula C10H12ClNO
Exact Mass 197.060742 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FGDTw2xRj01
Name 1-(4-Amino-3-chlorophenyl)butan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12ClNO
InChI InChI=1S/C10H12ClNO/c1-2-3-10(13)7-4-5-9(12)8(11)6-7/h4-6H,2-3,12H2,1H3
InChIKey AMBKVHMGXICXJT-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol200404z
Molecular Weight 197.665 g/mol
SMILES Nc1c(Cl)cc(C(CCC)=O)cc1
SPLASH splash10-0udi-1900000000-040240ff0d4e840cab5d
Source of Spectrum A1-13-2184/SMS9-16
Synonyms 1-(4-amino-3-chlorophenyl)-1-butanone 1-(4-azanyl-3-chloranyl-phenyl)butan-1-one
Wiley ID 1753129