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3-(4-Nitrophenyl)-3-oxo-1-(trichloromethyl)propyl acetate
SpectraBase Compound ID Avq6QPplTn7
InChI InChI=1S/C12H10Cl3NO5/c1-7(17)21-11(12(13,14)15)6-10(18)8-2-4-9(5-3-8)16(19)20/h2-5,11H,6H2,1H3
InChIKey VJYNFHDRZABBIO-UHFFFAOYSA-N
Mol Weight 354.57 g/mol
Molecular Formula C12H10Cl3NO5
Exact Mass 352.962456 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L71VuTv6UVo
Name 2-ACETOXY-1,1,1-TRICHLORO-4-(4-NITROPHENYL)-4-BUTANONE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H10Cl3NO5
InChI InChI=1S/C12H10Cl3NO5/c1-7(17)21-11(12(13,14)15)6-10(18)8-2-4-9(5-3-8)16(19)20/h2-5,11H,6H2,1H3
InChIKey VJYNFHDRZABBIO-UHFFFAOYSA-N
Molecular Weight 352.9623
SMILES c1(N(=O)=O)ccc(C(CC(OC(C)=O)C(Cl)(Cl)Cl)=O)cc1
SPLASH splash10-0f6x-9400000000-e8551f88673ff554692f
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany