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3-Butyl-4-ethoxy-3-cyclobutene-1,2-dione
SpectraBase Compound ID 17GzAT2jX0g
InChI InChI=1S/C10H14O3/c1-3-5-6-7-8(11)9(12)10(7)13-4-2/h3-6H2,1-2H3
InChIKey ANCPAAFBWTZQOR-UHFFFAOYSA-N
Mol Weight 182.22 g/mol
Molecular Formula C10H14O3
Exact Mass 182.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GkJtTzU1MC2
Name 3-Butyl-4-ethoxy-3-cyclobutene-1,2-dione
Alternate Name(s) 3-Butyl-4-ethoxy-cyclobut-3-ene-1,2-dione 3-Butyl-4-ethoxy-cyclobut-3-ene-1,2-quinone
CAS Registry Number 113976-76-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O3
InChI InChI=1S/C10H14O3/c1-3-5-6-7-8(11)9(12)10(7)13-4-2/h3-6H2,1-2H3
InChIKey ANCPAAFBWTZQOR-UHFFFAOYSA-N
Molecular Weight 182.219 g/mol
SMILES C1(=C(OCC)C(C1=O)=O)CCCC
SPLASH splash10-01t9-0900000000-a56b5efb2ce6562c10cf
Source of Spectrum J-53-2481-3
Wiley ID 1178478