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1-Cyclopropyl-2-(3-methoxyphenoxy)-1-(4-methoxyphenyl)-2-phenylethanol
SpectraBase Compound ID EqoK8lNd7AZ
InChI InChI=1S/C25H26O4/c1-27-21-15-13-20(14-16-21)25(26,19-11-12-19)24(18-7-4-3-5-8-18)29-23-10-6-9-22(17-23)28-2/h3-10,13-17,19,24,26H,11-12H2,1-2H3
InChIKey VJMLMKTYPAEJBM-UHFFFAOYSA-N
Mol Weight 390.48 g/mol
Molecular Formula C25H26O4
Exact Mass 390.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3umpWEu6168
Name 1-Cyclopropyl-2-(3-methoxyphenoxy)-1-(4-methoxyphenyl)-2-phenylethanol
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 390.183109313 u
Formula C25H26O4
InChI InChI=1S/C25H26O4/c1-27-21-15-13-20(14-16-21)25(26,19-11-12-19)24(18-7-4-3-5-8-18)29-23-10-6-9-22(17-23)28-2/h3-10,13-17,19,24,26H,11-12H2,1-2H3
InChIKey VJMLMKTYPAEJBM-UHFFFAOYSA-N
Instrument Name Agilent 6890N/5973
Ionization Type EI
Literature Reference DOI 10.1002/chem.201602254
Molecular Weight 390.479 g/mol
Quality 27
Reported Formula C25H26O4
SMILES OC(C1=CC=C(C=C1)OC)(C1CC1)C(C=1C=CC=CC1)OC=1C=CC=C(C1)OC
SPLASH splash10-004r-0900000000-0f448f206b932247be8d
Sample Comments Major isomer, Mixture of diastereoisomers = (7.5:1)
Source of Spectrum QE-22-SM18-6fa (DOI: 10.1002/chem.201602254)
Thin-Layer Chromatography 0.26 (hexane/EtOAc, 7:1)
Wiley ID 1905221