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3-Butyl-4-methoxy-3-cyclobutene-1,2-dione
SpectraBase Compound ID 9hCMpJ100EF
InChI InChI=1S/C9H12O3/c1-3-4-5-6-7(10)8(11)9(6)12-2/h3-5H2,1-2H3
InChIKey HQYVBGIRQSCYGF-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 EGSc04NVMO7
Name 3-Butyl-4-methoxy-3-cyclobutene-1,2-dione
CAS Registry Number 102683-52-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O3
InChI InChI=1S/C9H12O3/c1-3-4-5-6-7(10)8(11)9(6)12-2/h3-5H2,1-2H3
InChIKey HQYVBGIRQSCYGF-UHFFFAOYSA-N
Molecular Weight 168.192 g/mol
SMILES C1(C(=O)C(=C1OC)CCCC)=O
SPLASH splash10-0a6r-9500000000-c2424e6c2cdb52462d89
Source of Spectrum J-53-1002-4
Synonyms 3-Butyl-4-methoxy-cyclobut-3-ene-1,2-dione 3-Butyl-4-methoxy-cyclobut-3-ene-1,2-quinone
Wiley ID 1164365