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2-Cyclobuten-1-one, 2-butyl-3-ethoxy-4-hydroxy-4-(3-phenyl-1-propynyl)-
SpectraBase Compound ID LZWkkBpfIn3
InChI InChI=1S/C19H22O3/c1-3-5-13-16-17(20)19(21,18(16)22-4-2)14-9-12-15-10-7-6-8-11-15/h6-8,10-11,21H,3-5,12-13H2,1-2H3
InChIKey MQIXWOHADBCUAX-UHFFFAOYSA-N
Mol Weight 298.38 g/mol
Molecular Formula C19H22O3
Exact Mass 298.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1zKGkpdPrgi
Name 2-Cyclobuten-1-one, 2-butyl-3-ethoxy-4-hydroxy-4-(3-phenyl-1-propynyl)-
CAS Registry Number 118041-93-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22O3
InChI InChI=1S/C19H22O3/c1-3-5-13-16-17(20)19(21,18(16)22-4-2)14-9-12-15-10-7-6-8-11-15/h6-8,10-11,21H,3-5,12-13H2,1-2H3
InChIKey MQIXWOHADBCUAX-UHFFFAOYSA-N
Molecular Weight 298.382 g/mol
SMILES OC1(C(OCC)=C(C1=O)CCCC)C#CCc1ccccc1
SPLASH splash10-0aou-9570000000-a40a9f2832af623656d1
Source of Spectrum C-111-984-12
Synonyms 2-Butyl-3-ethoxy-4-hydroxy-4-(3-phenyl-1-propynyl)-2-cyclobuten-1-one 2-n-butyl-3-ethoxy-4-hydroxy-4-(3-phenyl-1-propynyl)-2-cyclobuten-1-one
Wiley ID 1301266