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Erythro-2-(Hydroxy-4'-methylphenylmethyl)-1-phenylbutan-1-one
SpectraBase Compound ID Jgp3jyO0j8Y
InChI InChI=1S/C18H20O2/c1-3-16(17(19)14-7-5-4-6-8-14)18(20)15-11-9-13(2)10-12-15/h4-12,16,18,20H,3H2,1-2H3/t16-,18-/m1/s1
InChIKey XATMEVLKTOVYGV-SJLPKXTDSA-N
Mol Weight 268.36 g/mol
Molecular Formula C18H20O2
Exact Mass 268.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5lBkU29cToL
Name Erythro-2-(Hydroxy-4'-methylphenylmethyl)-1-phenylbutan-1-one
Alternate Name(s) (S)-2-((S)-hydroxy(p-tolyl)methyl)-1-phenylbutan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O2
InChI InChI=1S/C18H20O2/c1-3-16(17(19)14-7-5-4-6-8-14)18(20)15-11-9-13(2)10-12-15/h4-12,16,18,20H,3H2,1-2H3/t16-,18-/m1/s1
InChIKey XATMEVLKTOVYGV-SJLPKXTDSA-N
Literature Reference DOI 10.1002_1615-4169(200206)344_3-4_283
Molecular Weight 268.356 g/mol
SMILES O[C@@]([C@@](C(c1ccccc1)=O)(CC)[H])(c1ccc(cc1)C)[H]
SPLASH splash10-05nb-2920000000-5702f1f90c76b62f4f2e
Source of Spectrum ASC-344-286-syn_5b
Wiley ID 1767184