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2-Cyclobuten-1-one, 4-(1-hexynyl)-4-hydroxy-3-methoxy-2-phenyl-
SpectraBase Compound ID 2oSqY9hpJsF
InChI InChI=1S/C17H18O3/c1-3-4-5-9-12-17(19)15(18)14(16(17)20-2)13-10-7-6-8-11-13/h6-8,10-11,19H,3-5H2,1-2H3
InChIKey PMTGZJUSLHAOMW-UHFFFAOYSA-N
Mol Weight 270.33 g/mol
Molecular Formula C17H18O3
Exact Mass 270.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1oMGUbMmcT1
Name 2-Cyclobuten-1-one, 4-(1-hexynyl)-4-hydroxy-3-methoxy-2-phenyl-
CAS Registry Number 118041-91-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O3
InChI InChI=1S/C17H18O3/c1-3-4-5-9-12-17(19)15(18)14(16(17)20-2)13-10-7-6-8-11-13/h6-8,10-11,19H,3-5H2,1-2H3
InChIKey PMTGZJUSLHAOMW-UHFFFAOYSA-N
Molecular Weight 270.328 g/mol
SMILES OC1(C(OC)=C(C1=O)c1ccccc1)C#CCCCC
SPLASH splash10-02dr-9410000000-21bc23eb53010c3448c7
Source of Spectrum J-57-335-0
Synonyms 4-Hex-1-ynyl-4-hydroxy-3-methoxy-2-phenyl-1-cyclobut-2-enone 4-Hex-1-ynyl-4-hydroxy-3-methoxy-2-phenylcyclobut-2-en-1-one 4-Hex-1-ynyl-3-methoxy-4-oxidanyl-2-phenyl-cyclobut-2-en-1-one
Wiley ID 1274581