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(S)-methyl 2-[4-(o-tolyl)phenoxy]-3-phenyl-propanoate
SpectraBase Compound ID 13iQIQs5pgG
InChI InChI=1S/C23H22O3/c1-17-8-6-7-11-21(17)19-12-14-20(15-13-19)26-22(23(24)25-2)16-18-9-4-3-5-10-18/h3-15,22H,16H2,1-2H3/t22-/m0/s1
InChIKey UZIPUCZJHPGTJN-QFIPXVFZSA-N
Mol Weight 346.43 g/mol
Molecular Formula C23H22O3
Exact Mass 346.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HwkRLY5sDWn
Name (S)-methyl 2-[4-(o-tolyl)phenoxy]-3-phenyl-propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H22O3
InChI InChI=1S/C23H22O3/c1-17-8-6-7-11-21(17)19-12-14-20(15-13-19)26-22(23(24)25-2)16-18-9-4-3-5-10-18/h3-15,22H,16H2,1-2H3/t22-/m0/s1
InChIKey UZIPUCZJHPGTJN-QFIPXVFZSA-N
Instrument Name HP GC/MS 6890-5973 MSD
Ionization Type EI
Literature Reference DOI 10.1021/jm301018z
Molecular Weight 346.426 g/mol
SMILES Cc1c(cccc1)-c1ccc(cc1)O[C@](C(=O)OC)(Cc1ccccc1)[H]
SPLASH splash10-006t-0609000000-077d66a1ab2e82d8e2a0
Source of Spectrum AF-56-SM5-5-3
Wiley ID 1854394