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(S)-Ethyl 2-(2,2'-dimethyl-biphenyl-4-yloxy)-3-phenylpropanoate
SpectraBase Compound ID KmdlDAET3Uz
InChI InChI=1S/C25H26O3/c1-4-27-25(26)24(17-20-11-6-5-7-12-20)28-21-14-15-23(19(3)16-21)22-13-9-8-10-18(22)2/h5-16,24H,4,17H2,1-3H3/t24-/m0/s1
InChIKey NYDBPQXNCAMWOT-DEOSSOPVSA-N
Mol Weight 374.48 g/mol
Molecular Formula C25H26O3
Exact Mass 374.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CH8xmcMaWfS
Name (S)-Ethyl 2-(2,2'-dimethyl-biphenyl-4-yloxy)-3-phenylpropanoate
Appearance Colorless or yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H26O3
InChI InChI=1S/C25H26O3/c1-4-27-25(26)24(17-20-11-6-5-7-12-20)28-21-14-15-23(19(3)16-21)22-13-9-8-10-18(22)2/h5-16,24H,4,17H2,1-3H3/t24-/m0/s1
InChIKey NYDBPQXNCAMWOT-DEOSSOPVSA-N
Instrument Name HP GC/MS 6890-5973 MSD
Ionization Type EI
Literature Reference DOI 10.1021/jm301018z
Molecular Weight 374.480 g/mol
SMILES C(C)OC([C@](Cc1ccccc1)(Oc1cc(c(cc1)-c1c(cccc1)C)C)[H])=O
SPLASH splash10-00di-0509000000-45435a3ea0984f1e4869
Source of Spectrum AF-56-SM3-21i
Wiley ID 1854382