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3-Methyl-4-(4'-nitrophenyl)-3-buten-2-one
SpectraBase Compound ID 3x2Mk4T18so
InChI InChI=1S/C11H11NO3/c1-8(9(2)13)7-10-3-5-11(6-4-10)12(14)15/h3-7H,1-2H3/b8-7+
InChIKey HOSZCLQZBNGFIS-BQYQJAHWSA-N
Mol Weight 205.21 g/mol
Molecular Formula C11H11NO3
Exact Mass 205.073893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4E6n67pd0C
Name 3-Methyl-4-(4'-nitrophenyl)-3-buten-2-one
Alternate Name(s) (E)-3-methyl-4-(4-nitrophenyl)but-3-en-2-one (E)-3-methyl-4-(4-nitrophenyl)-3-buten-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11NO3
InChI InChI=1S/C11H11NO3/c1-8(9(2)13)7-10-3-5-11(6-4-10)12(14)15/h3-7H,1-2H3/b8-7+
InChIKey HOSZCLQZBNGFIS-BQYQJAHWSA-N
Molecular Weight 205.213 g/mol
SMILES c1(N(=O)=O)ccc(\C=C\(C(=O)C)C)cc1
SPLASH splash10-014r-0900000000-6b38f7c7c62a4e69468b
Source of Spectrum F-24-978-4e
Wiley ID 1738897