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6-(4-Methoxy-benzyl)-1,3-benzodioxol-5-yl-2-propen-1-one
SpectraBase Compound ID 1xDqsIgKjZY
InChI InChI=1S/C18H16O4/c1-3-16(19)15-10-18-17(21-11-22-18)9-13(15)8-12-4-6-14(20-2)7-5-12/h3-7,9-10H,1,8,11H2,2H3
InChIKey DDEBBZBTXMDVID-UHFFFAOYSA-N
Mol Weight 296.32 g/mol
Molecular Formula C18H16O4
Exact Mass 296.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6L80Ki0Efj7
Name 2-Propen-1-one, 1-[6-[(4-methoxyphenyl)methyl]-1,3-benzodioxol-5-yl]-
CAS Registry Number 112533-19-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16O4
InChI InChI=1S/C18H16O4/c1-3-16(19)15-10-18-17(21-11-22-18)9-13(15)8-12-4-6-14(20-2)7-5-12/h3-7,9-10H,1,8,11H2,2H3
InChIKey DDEBBZBTXMDVID-UHFFFAOYSA-N
Molecular Weight 296.322 g/mol
SMILES c1(c(cc2c(c1)OCO2)C(C=C)=O)Cc1ccc(cc1)OC
SPLASH splash10-00di-0920000000-657061dd455f334bab62
Source of Spectrum C-110-1564-5
Synonyms 1-[6-(4-methoxybenzyl)-1,3-benzodioxol-5-yl]-2-propen-1-one 6-(methoxyphenyl)methyl-1,3-benzodioxol-5-yl-2-propen-1-one
Wiley ID 1299273