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(E)-2-monodeuteromethyl-1,5-diphenylpent-1-en-3-one
SpectraBase Compound ID 3MDyYwdzfJk
InChI InChI=1S/C18H18O/c1-15(14-17-10-6-3-7-11-17)18(19)13-12-16-8-4-2-5-9-16/h2-11,14H,12-13H2,1H3/b15-14+/i1D
InChIKey LANCKCUPQAFAQG-QZYHZLNOSA-N
Mol Weight 251.35 g/mol
Molecular Formula C18H17DO
Exact Mass 251.142042 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2HcxT937qb9
Name (E)-2-monodeuteromethyl-1,5-diphenylpent-1-en-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17DO
InChI InChI=1S/C18H18O/c1-15(14-17-10-6-3-7-11-17)18(19)13-12-16-8-4-2-5-9-16/h2-11,14H,12-13H2,1H3/b15-14+/i1D
InChIKey LANCKCUPQAFAQG-QZYHZLNOSA-N
Literature Reference DOI 10.1021/ol400862k
Molecular Weight 251.347 g/mol
SMILES c1cc(CCC(\C(C[D])=C\c2ccccc2)=O)ccc1
SPLASH splash10-014j-1930000000-5a71d165d5f3a9d3abca
Source of Spectrum A1-15-2286/SMS15-(E_3ae_d)
Wiley ID 1748659