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KETOLACTONE
SpectraBase Compound ID 3r8JMX5Yfvx
InChI InChI=1S/C9H14O3/c10-8-4-1-2-6-9(11)12-7-3-5-8/h1-7H2
InChIKey XVJSPKCFYMUFRT-UHFFFAOYSA-N
Mol Weight 170.21 g/mol
Molecular Formula C9H14O3
Exact Mass 170.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6JbhOlKyf05
Name 2,7-Oxecanedione
Alternate Name(s) 6-Ketononanolide Oxecane-2,7-dione Oxecane-2,7-quinone
CAS Registry Number 13030-92-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O3
InChI InChI=1S/C9H14O3/c10-8-4-1-2-6-9(11)12-7-3-5-8/h1-7H2
InChIKey XVJSPKCFYMUFRT-UHFFFAOYSA-N
Molecular Weight 170.208 g/mol
SMILES C1(=O)CCCCC(=O)OCCC1
SPLASH splash10-001i-9100000000-784dd5075afd395f4b00
Source of Spectrum Y-12-103-0
Wiley ID 1166559