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3-(Chloromethyl)-4-(3'-nitrophenyl)-3-buten-2-one
SpectraBase Compound ID J7gDXTDd6hT
InChI InChI=1S/C11H10ClNO3/c1-8(14)10(7-12)5-9-3-2-4-11(6-9)13(15)16/h2-6H,7H2,1H3/b10-5+
InChIKey TZUIQAKTUAFPOJ-BJMVGYQFSA-N
Mol Weight 239.66 g/mol
Molecular Formula C11H10ClNO3
Exact Mass 239.034921 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JYbL0yHAra5
Name 3-(Chloromethyl)-4-(3'-nitrophenyl)-3-buten-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H10ClNO3
InChI InChI=1S/C11H10ClNO3/c1-8(14)10(7-12)5-9-3-2-4-11(6-9)13(15)16/h2-6H,7H2,1H3/b10-5+
InChIKey TZUIQAKTUAFPOJ-BJMVGYQFSA-N
Molecular Weight 239.658 g/mol
SMILES c1(N(=O)=O)cc(\C=C\(C(=O)C)CCl)ccc1
SPLASH splash10-006x-5290000000-4b7cf18dec3336d512f2
Source of Spectrum F-56-4796-3
Synonyms (3Z)-3-(chloromethyl)-4-(3-nitrophenyl)-3-buten-2-one 3-Chloromethyl-4-(3'-nitrophenyl)-3-buten-2-one (Z)-3-(chloromethyl)-4-(3-nitrophenyl)but-3-en-2-one
Wiley ID 856663