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4-[Benzyl(chloroacetyl)amino]buta-1,3-diene
SpectraBase Compound ID JJZ8xGJCXZ4
InChI InChI=1S/C13H14ClNO/c1-2-3-9-15(13(16)10-14)11-12-7-5-4-6-8-12/h2-9H,1,10-11H2/b9-3-
InChIKey GHOSQHXMGTWWTH-OQFOIZHKSA-N
Mol Weight 235.71 g/mol
Molecular Formula C13H14ClNO
Exact Mass 235.076392 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1uOUY1mvsd1
Name 4-[Benzyl(chloroacetyl)amino]buta-1,3-diene
Comments Less than 3 mono-isotopic peaks
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Formula C13H14ClNO
InChI InChI=1S/C13H14ClNO/c1-2-3-9-15(13(16)10-14)11-12-7-5-4-6-8-12/h2-9H,1,10-11H2/b9-3-
InChIKey GHOSQHXMGTWWTH-OQFOIZHKSA-N
Molecular Weight 235.714 g/mol
SMILES C(N(\C=C/C=C)Cc1ccccc1)(=O)CCl
SPLASH splash10-0006-9000000000-21c3646c691e90a4333e
Source of Spectrum J-63-807-15
Synonyms N-benzyl-N-[(1Z)-1,3-butadienyl]-2-chloroacetamide
Wiley ID 1237067