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4'-Methoxybutyrophenone
SpectraBase Compound ID G5I1vlvGBwh
InChI InChI=1S/C11H14O2/c1-3-4-11(12)9-5-7-10(13-2)8-6-9/h5-8H,3-4H2,1-2H3
InChIKey JLCDSZXBELPBRD-UHFFFAOYSA-N
Mol Weight 178.23 g/mol
Molecular Formula C11H14O2
Exact Mass 178.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DMtakqkv5yL
Name 4'-Methoxybutyrophenone
CAS Registry Number 4160-51-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O2
InChI InChI=1S/C11H14O2/c1-3-4-11(12)9-5-7-10(13-2)8-6-9/h5-8H,3-4H2,1-2H3
InChIKey JLCDSZXBELPBRD-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol200404z
Molecular Weight 178.231 g/mol
SMILES c1c(OC)ccc(C(CCC)=O)c1
SPLASH splash10-000i-2900000000-b5399dd6241f05f0c13f
Source of Spectrum A1-13-2184/SMS6-4
Synonyms 1-(4-Methoxyphenyl)butan-1-one 1-(4-Methoxyphenyl)butane-1-one 1-(4-Methoxyphenyl)-1-butanone 1-Butanone, 1-(4-methoxyphenyl)- 4-Methoxybutyrophenone Butyrophenone, 4'-methoxy- p-Methoxybutyrophenone
Wiley ID 1753130