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2-n-Butyl-4-hydroxy-3-methoxy-4-(1-(phenylmethyl)ethenyl)-2-cyclobuten-1-one

View entire compound with spectra: 1 MS (GC)

2-n-Butyl-4-hydroxy-3-methoxy-4-(1-(phenylmethyl)ethenyl)-2-cyclobuten-1-one
SpectraBase Compound ID LsKJgw5aXuj
InChI InChI=1S/C18H22O3/c1-4-5-11-15-16(19)18(20,17(15)21-3)13(2)12-14-9-7-6-8-10-14/h6-10,20H,2,4-5,11-12H2,1,3H3
InChIKey GCCAYAJTJBYTMU-UHFFFAOYSA-N
Mol Weight 286.37 g/mol
Molecular Formula C18H22O3
Exact Mass 286.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3i6jaEl49T6
Name 2-n-Butyl-4-hydroxy-3-methoxy-4-(1-(phenylmethyl)ethenyl)-2-cyclobuten-1-one
Alternate Name(s) 4-(1-benzylvinyl)-2-butyl-4-hydroxy-3-methoxy-2-cyclobuten-1-one
CAS Registry Number 124603-09-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22O3
InChI InChI=1S/C18H22O3/c1-4-5-11-15-16(19)18(20,17(15)21-3)13(2)12-14-9-7-6-8-10-14/h6-10,20H,2,4-5,11-12H2,1,3H3
InChIKey GCCAYAJTJBYTMU-UHFFFAOYSA-N
Molecular Weight 286.371 g/mol
SMILES OC1(C(OC)=C(C1=O)CCCC)C(Cc1ccccc1)=C
SPLASH splash10-0006-9720000000-0dda884fdb07195a04ce
Source of Spectrum C-112-1902-10
Wiley ID 1290180