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(E)-4-(3'-Pyridyl)-3-buten-2-one

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

(E)-4-(3'-Pyridyl)-3-buten-2-one
SpectraBase Compound ID B2LdC5x1J67
InChI InChI=1S/C9H9NO/c1-8(11)4-5-9-3-2-6-10-7-9/h2-7H,1H3/b5-4+
InChIKey USGRQYQNEMWBIP-SNAWJCMRSA-N
Mol Weight 147.18 g/mol
Molecular Formula C9H9NO
Exact Mass 147.068414 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8d7YSkDLVcf
Name (E)-4-(3'-Pyridyl)-3-buten-2-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9NO
InChI InChI=1S/C9H9NO/c1-8(11)4-5-9-3-2-6-10-7-9/h2-7H,1H3/b5-4+
InChIKey USGRQYQNEMWBIP-SNAWJCMRSA-N
Literature Reference DOI 10.1002/adsc.200900902
Molecular Weight 147.177 g/mol
SMILES c1cc(\C=C\C(C)=O)cnc1
SPLASH splash10-0f8a-0900000000-21f8d6a6d94019c667fd
Source of Spectrum ASC-352-1135/SM12-4r
Synonyms (E)-4-(pyridin-3-yl)but-3-en-2-one (E)-4-(3-pyridinyl)-3-buten-2-one (E)-4-pyridin-3-ylbut-3-en-2-one
Wiley ID 1764408