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Ethanone, 1-(1H-pyrrol-3-yl)-
SpectraBase Compound ID Db5u04vo2je
InChI InChI=1S/C6H7NO/c1-5(8)6-2-3-7-4-6/h2-4,7H,1H3
InChIKey KHHSXHXUQVNBGA-UHFFFAOYSA-N
Mol Weight 109.13 g/mol
Molecular Formula C6H7NO
Exact Mass 109.052764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H7iEl3Pj4WC
Name Ethanone, 1-(1H-pyrrol-3-yl)-
CAS Registry Number 1072-82-8
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H7NO
InChI InChI=1S/C6H7NO/c1-5(8)6-2-3-7-4-6/h2-4,7H,1H3
InChIKey KHHSXHXUQVNBGA-UHFFFAOYSA-N
Molecular Weight 109.128 g/mol
SMILES [nH]1ccc(c1)C(C)=O
SPLASH splash10-052f-9500000000-2b726899c586d21f845d
Source of Spectrum E1-44-53-16
Synonyms 1-(1H-pyrrol-3-yl)ethanone 3-Acetyl-1H-pyrrole 3-Acetylpyrrole Methyl pyrrol-3-yl ketone
Wiley ID 1553242