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N-(1-Phenylethyl)-2-(2-bromo-4,5-methylenedioxyphenyl)ethamine
SpectraBase Compound ID KHTP4bkWgNX
InChI InChI=1S/C17H18BrNO2/c1-12(13-5-3-2-4-6-13)19-8-7-14-9-16-17(10-15(14)18)21-11-20-16/h2-6,9-10,12,19H,7-8,11H2,1H3
InChIKey AQACVTWHHRAPFP-UHFFFAOYSA-N
Mol Weight 348.24 g/mol
Molecular Formula C17H18BrNO2
Exact Mass 347.052092 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L99uUYvPX29
Name N-(1-Phenylethyl)-2-(2-bromo-4,5-methylenedioxyphenyl)ethamine
Alternate Name(s) N-[2-(6-bromo-1,3-benzodioxol-5-yl)ethyl]-1-phenylethanamine N-[2-(6-bromo-1,3-benzodioxol-5-yl)ethyl]-1-phenyl-ethanamine N-[2-(6-bromanyl-1,3-benzodioxol-5-yl)ethyl]-1-phenyl-ethanamine
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Formula C17H18BrNO2
InChI InChI=1S/C17H18BrNO2/c1-12(13-5-3-2-4-6-13)19-8-7-14-9-16-17(10-15(14)18)21-11-20-16/h2-6,9-10,12,19H,7-8,11H2,1H3
InChIKey AQACVTWHHRAPFP-UHFFFAOYSA-N
Molecular Weight 348.240 g/mol
SMILES N(CCc1cc2c(cc1Br)OCO2)C(c1ccccc1)C
SPLASH splash10-00lr-0940000000-d81bdf6724d336e270a5
Source of Spectrum O1-57-2157-12
Wiley ID 1591767