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(E)-4-(4-Nitrophenyl)-3-buten-2-one
SpectraBase Compound ID BGTq2J4p2X9
InChI InChI=1S/C10H9NO3/c1-8(12)2-3-9-4-6-10(7-5-9)11(13)14/h2-7H,1H3/b3-2+
InChIKey KMCRQJMZUHNLKJ-NSCUHMNNSA-N
Mol Weight 191.19 g/mol
Molecular Formula C10H9NO3
Exact Mass 191.058243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 70nvl4OAYQ1
Name (E)-4-(4-Nitrophenyl)-3-buten-2-one
CAS Registry Number 3490-37-7
Comments Less than 3 mono-isotopic peaks
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Formula C10H9NO3
InChI InChI=1S/C10H9NO3/c1-8(12)2-3-9-4-6-10(7-5-9)11(13)14/h2-7H,1H3/b3-2+
InChIKey KMCRQJMZUHNLKJ-NSCUHMNNSA-N
Molecular Weight 191.186 g/mol
SMILES c1(N(=O)=O)ccc(\C=C\C(=O)C)cc1
SPLASH splash10-0006-9100000000-44f59cf534922283fd39
Source of Spectrum CV-0-41-3
Synonyms 4-(4-Nitrophenyl)-3-buten-2-one (E)-4-(4-nitrophenyl)but-3-en-2-one (E)-4-(4'-Nitrophenyl-3-buten-2-one 3-Buten-2-one, 4-(4-nitrophenyl)-, (Z)- 4-(p-Nitrophenyl)-3-buten-2-one (3Z)-4-(4-Nitrophenyl)-3-buten-2-one p-Nitrobenzalacetone 3-Buten-2-one 4-[p-nitrophenyl]-cis-
Wiley ID 872806