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4-[[2-[(3-methyl-2-butenyl)oxy]phenyl]methylene]-3-phenylisoxazol-5[4H]-one
SpectraBase Compound ID 1VgweDsrBlN
InChI InChI=1S/C21H19NO3/c1-15(2)12-13-24-19-11-7-6-10-17(19)14-18-20(22-25-21(18)23)16-8-4-3-5-9-16/h3-12,14H,13H2,1-2H3/b18-14-
InChIKey HTHYPKCJDGTCOF-JXAWBTAJSA-N
Mol Weight 333.39 g/mol
Molecular Formula C21H19NO3
Exact Mass 333.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LGokEsl3H44
Name 4-[[2-[(3-methyl-2-butenyl)oxy]phenyl]methylene]-3-phenylisoxazol-5[4H]-one
CAS Registry Number 112296-80-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19NO3
InChI InChI=1S/C21H19NO3/c1-15(2)12-13-24-19-11-7-6-10-17(19)14-18-20(22-25-21(18)23)16-8-4-3-5-9-16/h3-12,14H,13H2,1-2H3/b18-14-
InChIKey HTHYPKCJDGTCOF-JXAWBTAJSA-N
Molecular Weight 333.387 g/mol
SMILES C=1(\C(C(ON1)=O)=C\c1c(OCC=C(C)C)cccc1)c1ccccc1
SPLASH splash10-00di-0091000000-8f6873c22ea5936140ee
Source of Spectrum J-53-818-18
Synonyms (4Z)-4-{2-[(3-methyl-2-butenyl)oxy]benzylidene}-3-phenyl-5(4H)-isoxazolone (4Z)-4-[[2-(3-methylbut-2-enoxy)phenyl]methylidene]-3-phenyl-5-isoxazolone (4Z)-4-[[2-(3-methylbut-2-enoxy)phenyl]methylene]-3-phenyl-isoxazol-5-one (4Z)-4-[[2-(3-methylbut-2-enoxy)phenyl]methylidene]-3-phenyl-1,2-oxazol-5-one
Wiley ID 1330390