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2,3-Dimethoxy-4-hydroxy-4-[3-[(tetrahydropyran-2-yl)oxy]-1-propynyl]-2-cyclobuten-1-one
SpectraBase Compound ID 1TcVHusCuFD
InChI InChI=1S/C14H18O6/c1-17-11-12(15)14(16,13(11)18-2)7-5-9-20-10-6-3-4-8-19-10/h10,16H,3-4,6,8-9H2,1-2H3
InChIKey LBNVUGATGLWQME-UHFFFAOYSA-N
Mol Weight 282.29 g/mol
Molecular Formula C14H18O6
Exact Mass 282.110338 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BVP1lqKkhe1
Name 2,3-Dimethoxy-4-hydroxy-4-[3-[(tetrahydropyran-2-yl)oxy]-1-propynyl]-2-cyclobuten-1-one
CAS Registry Number 113976-72-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O6
InChI InChI=1S/C14H18O6/c1-17-11-12(15)14(16,13(11)18-2)7-5-9-20-10-6-3-4-8-19-10/h10,16H,3-4,6,8-9H2,1-2H3
InChIKey LBNVUGATGLWQME-UHFFFAOYSA-N
Molecular Weight 282.292 g/mol
SMILES OC1(C(OC)=C(C1=O)OC)C#CCOC1OCCCC1
SPLASH splash10-00di-0900000000-7da259f829fc49a5b2a6
Source of Spectrum J-53-2480-2
Synonyms 4-Hydroxy-2,3-dimethoxy-4-[3-(tetrahydro-2H-pyran-2-yloxy)-1-propynyl]-2-cyclobuten-1-one
Wiley ID 1285631