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(3E)-4-(1-Acetyl-2,2-dimethylcyclopentyl)-3-buten-2-one
SpectraBase Compound ID FY5C696UA8h
InChI InChI=1S/C13H20O2/c1-10(14)6-9-13(11(2)15)8-5-7-12(13,3)4/h6,9H,5,7-8H2,1-4H3/b9-6+
InChIKey KYZXRNPRKAPWRL-RMKNXTFCSA-N
Mol Weight 208.3 g/mol
Molecular Formula C13H20O2
Exact Mass 208.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 94ZJKEiSVto
Name (3E)-4-(1-Acetyl-2,2-dimethylcyclopentyl)-3-buten-2-one
CAS Registry Number 65868-85-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O2
InChI InChI=1S/C13H20O2/c1-10(14)6-9-13(11(2)15)8-5-7-12(13,3)4/h6,9H,5,7-8H2,1-4H3/b9-6+
InChIKey KYZXRNPRKAPWRL-RMKNXTFCSA-N
Molecular Weight 208.301 g/mol
SMILES C1(CCCC1(C)C)(\C=C\C(C)=O)C(C)=O
SPLASH splash10-0fr6-7900000000-7c2779d60dd7172f0924
Synonyms (E)-4-(1-acetyl-2,2-dimethyl-cyclopentyl)but-3-en-2-one (E)-4-(1-acetyl-2,2-dimethylcyclopentyl)-3-buten-2-one (E)-4-(1-ethanoyl-2,2-dimethyl-cyclopentyl)but-3-en-2-one 1-Buten-3-one, 1-(1-acetyl-5,5-dimethylcyclopentyl)-
Wiley ID 1477826