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3-amylcyclobut-3-ene-1,2-quinone
SpectraBase Compound ID DFfqLy9AQhH
InChI InChI=1S/C9H12O2/c1-2-3-4-5-7-6-8(10)9(7)11/h6H,2-5H2,1H3
InChIKey TXOZPCNORCJKCA-UHFFFAOYSA-N
Mol Weight 152.19 g/mol
Molecular Formula C9H12O2
Exact Mass 152.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2nygpdptx0Y
Name 3-amylcyclobut-3-ene-1,2-quinone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O2
InChI InChI=1S/C9H12O2/c1-2-3-4-5-7-6-8(10)9(7)11/h6H,2-5H2,1H3
InChIKey TXOZPCNORCJKCA-UHFFFAOYSA-N
Molecular Weight 152.193 g/mol
SMILES C1(=CC(C1=O)=O)CCCCC
SPLASH splash10-0udi-4900000000-a0108ad5ffcc2bb45d9d
Source of Spectrum SK-25-2787-3
Synonyms 3-pentylcyclobut-3-ene-1,2-dione
Wiley ID 866860