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2-Cyclobuten-1-one, 3-ethoxy-4-hydroxy-2-phenyl-4-(3-phenyl-1-propynyl)-
SpectraBase Compound ID LN4nPMqQx4j
InChI InChI=1S/C21H18O3/c1-2-24-20-18(17-13-7-4-8-14-17)19(22)21(20,23)15-9-12-16-10-5-3-6-11-16/h3-8,10-11,13-14,23H,2,12H2,1H3
InChIKey CWTCUMRHTDDKQX-UHFFFAOYSA-N
Mol Weight 318.37 g/mol
Molecular Formula C21H18O3
Exact Mass 318.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Q0CqcIvM7r
Name 2-Cyclobuten-1-one, 3-ethoxy-4-hydroxy-2-phenyl-4-(3-phenyl-1-propynyl)-
CAS Registry Number 118041-92-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18O3
InChI InChI=1S/C21H18O3/c1-2-24-20-18(17-13-7-4-8-14-17)19(22)21(20,23)15-9-12-16-10-5-3-6-11-16/h3-8,10-11,13-14,23H,2,12H2,1H3
InChIKey CWTCUMRHTDDKQX-UHFFFAOYSA-N
Molecular Weight 318.372 g/mol
SMILES OC1(C(OCC)=C(C1=O)c1ccccc1)C#CCc1ccccc1
SPLASH splash10-014r-9845000000-9d4bd6b1cb5f2b7d6a61
Source of Spectrum C-111-984-12
Synonyms 3-Ethoxy-4-hydroxy-2-phenyl-4-(3-phenyl-1-propynyl)-2-cyclobuten-1-one
Wiley ID 1318879