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4-(1-Butyl)-4-hydroxy-3-methoxy-2-phenyl-2-cyclobuten-1-one

View entire compound with spectra: 1 MS (GC)

4-(1-Butyl)-4-hydroxy-3-methoxy-2-phenyl-2-cyclobuten-1-one
SpectraBase Compound ID 5Cm19cpoJ2c
InChI InChI=1S/C15H18O3/c1-3-4-10-15(17)13(16)12(14(15)18-2)11-8-6-5-7-9-11/h5-9,17H,3-4,10H2,1-2H3
InChIKey WSEPITMLSYZIDR-UHFFFAOYSA-N
Mol Weight 246.31 g/mol
Molecular Formula C15H18O3
Exact Mass 246.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ARfIUZftr4u
Name 4-(1-Butyl)-4-hydroxy-3-methoxy-2-phenyl-2-cyclobuten-1-one
Alternate Name(s) 4-Butyl-4-hydroxy-3-methoxy-2-phenyl-2-cyclobuten-1-one
CAS Registry Number 122745-90-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O3
InChI InChI=1S/C15H18O3/c1-3-4-10-15(17)13(16)12(14(15)18-2)11-8-6-5-7-9-11/h5-9,17H,3-4,10H2,1-2H3
InChIKey WSEPITMLSYZIDR-UHFFFAOYSA-N
Molecular Weight 246.306 g/mol
SMILES OC1(C(C(=C1OC)c1ccccc1)=O)CCCC
SPLASH splash10-00or-1930000000-6d350884feba2e0082c2
Source of Spectrum J-57-334-0
Wiley ID 1249261