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(E)-4-(4-chlorophenyl)but-3-en-2-amine
SpectraBase Compound ID 53ZzIfmxvwP
InChI InChI=1S/C10H12ClN/c1-8(12)2-3-9-4-6-10(11)7-5-9/h2-8H,12H2,1H3/b3-2+
InChIKey XTGRSNOKWGAPPK-NSCUHMNNSA-N
Mol Weight 181.67 g/mol
Molecular Formula C10H12ClN
Exact Mass 181.065827 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8qtEczAr1rx
Name (E)-4-(4-chlorophenyl)but-3-en-2-amine
Appearance Yellowish oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12ClN
InChI InChI=1S/C10H12ClN/c1-8(12)2-3-9-4-6-10(11)7-5-9/h2-8H,12H2,1H3/b3-2+
InChIKey XTGRSNOKWGAPPK-NSCUHMNNSA-N
Instrument Name Agilent Technologies 7890A-5975C
Ionization Type EI
Literature Reference DOI 10.1002/cctc.202001707
Molecular Weight 181.666 g/mol
SMILES NC(\C=C\c1ccc(cc1)Cl)C
SPLASH splash10-00lr-3900000000-c01f6ae8efe84f1e7a6a
Source of Spectrum CCC-13-SM66-2c
Thin-Layer Chromatography Rf = 0.35 (cyclohexane/EtOAc, 7:3)
Wiley ID 1856530