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 Google Search
Mol Weight	235.71 g/mol
Molecular Formula	C13H14ClNO
Exact Mass	235.076392 g/mol

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SpectraBase Spectrum ID	1uOUY1mvsd1
Name	4-[Benzyl(chloroacetyl)amino]buta-1,3-diene
Alternate Name(s)	N-benzyl-N-[(1Z)-1,3-butadienyl]-2-chloroacetamide
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
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
Wiley ID	1237067