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1,2,4-Cyclopentanetrione, 3-butyl-
SpectraBase Compound ID 49t3twufcPY
InChI InChI=1S/C9H12O3/c1-2-3-4-6-7(10)5-8(11)9(6)12/h6H,2-5H2,1H3
InChIKey HMFXLRRRGHKBCH-UHFFFAOYSA-N
Mol Weight 168.19 g/mol
Molecular Formula C9H12O3
Exact Mass 168.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H6b4ZizWnKO
Name 1,2,4-Cyclopentanetrione, 3-butyl-
CAS Registry Number 46005-09-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O3
InChI InChI=1S/C9H12O3/c1-2-3-4-6-7(10)5-8(11)9(6)12/h6H,2-5H2,1H3
InChIKey HMFXLRRRGHKBCH-UHFFFAOYSA-N
Molecular Weight 168.192 g/mol
SMILES CCCCC1C(=O)CC(=O)C1=O
SPLASH splash10-002f-9700000000-7737b4e99c7b3f71d9b1
Source of Spectrum OS-6-251-0
Synonyms 3-Butyl-1,2,4-cyclopentanetrione 3-Butylcyclopentane-1,2,4-trione
Wiley ID 1164285