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2-(2-Bromo-4-fluorophenyl)propan-2-amine
SpectraBase Compound ID HYFa3U2Z0bN
InChI InChI=1S/C9H11BrFN/c1-9(2,12)7-4-3-6(11)5-8(7)10/h3-5H,12H2,1-2H3
InChIKey HZSYKKRMPCXOLQ-UHFFFAOYSA-N
Mol Weight 232.1 g/mol
Molecular Formula C9H11BrFN
Exact Mass 231.005891 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4wNoP38SW0
Name 2-(2-Bromo-4-fluorophenyl)propan-2-amine
Appearance Yellow oil
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Exact Mass 231.005890521 u
Formula C9H11BrFN
InChI InChI=1S/C9H11BrFN/c1-9(2,12)7-4-3-6(11)5-8(7)10/h3-5H,12H2,1-2H3
InChIKey HZSYKKRMPCXOLQ-UHFFFAOYSA-N
Instrument Name Waters AutoSpec Premier
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.2c02797
Molecular Weight 232.096 g/mol
Quality 100
Reported Formula C9H11NFBr
SMILES NC(C=1C=CC(=CC1Br)F)(C)C
SPLASH splash10-014i-5290000000-e53e853340b1f3f20556
Source of Spectrum JOC-88-SM7-S2f (DOI: 10.1021/acs.joc.2c02797)
Thin-Layer Chromatography 0.20 (Hexane/EtOAc, 1:2)
Wiley ID 1912669