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3-tert-butoxy-4-ethynyl-4-hydroxy-2-methylcyclobut-2-en-1-one
SpectraBase Compound ID JU8hD76v1hf
InChI InChI=1S/C11H14O3/c1-6-11(13)8(12)7(2)9(11)14-10(3,4)5/h1,13H,2-5H3
InChIKey HKHXLJIJZYJZAY-UHFFFAOYSA-N
Mol Weight 194.23 g/mol
Molecular Formula C11H14O3
Exact Mass 194.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4zD03McQWgC
Name 3-tert-butoxy-4-ethynyl-4-hydroxy-2-methylcyclobut-2-en-1-one
Alternate Name(s) 3-tert-butoxy-4-ethynyl-4-hydroxy-2-methyl-2-cyclobuten-1-one
CAS Registry Number 124175-63-9
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O3
InChI InChI=1S/C11H14O3/c1-6-11(13)8(12)7(2)9(11)14-10(3,4)5/h1,13H,2-5H3
InChIKey HKHXLJIJZYJZAY-UHFFFAOYSA-N
Molecular Weight 194.230 g/mol
SMILES OC1(C(=C(C1=O)C)OC(C)(C)C)C#C
SPLASH splash10-0a4i-9100000000-7d75909e666127adb5a4
Source of Spectrum J-55-1183-27
Wiley ID 1190752