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1-methoxy-4-[(1S)-3,3,3-trichloro-1-(4-phenylbutoxy)propyl]benzene
SpectraBase Compound ID 91B65czfDLW
InChI InChI=1S/C20H23Cl3O2/c1-24-18-12-10-17(11-13-18)19(15-20(21,22)23)25-14-6-5-9-16-7-3-2-4-8-16/h2-4,7-8,10-13,19H,5-6,9,14-15H2,1H3/t19-/m0/s1
InChIKey NCTYLBAPBJAWPU-IBGZPJMESA-N
Mol Weight 401.76 g/mol
Molecular Formula C20H23Cl3O2
Exact Mass 400.076363 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K69eoZUTwW2
Name 1-methoxy-4-[(1S)-3,3,3-trichloro-1-(4-phenylbutoxy)propyl]benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23Cl3O2
InChI InChI=1S/C20H23Cl3O2/c1-24-18-12-10-17(11-13-18)19(15-20(21,22)23)25-14-6-5-9-16-7-3-2-4-8-16/h2-4,7-8,10-13,19H,5-6,9,14-15H2,1H3/t19-/m0/s1
InChIKey NCTYLBAPBJAWPU-IBGZPJMESA-N
Instrument Name LRMS
Ionization Type EI
Molecular Weight 401.761 g/mol
SMILES c1cc(ccc1OC)[C@@](OCCCCc1ccccc1)(CC(Cl)(Cl)Cl)[H]
SPLASH splash10-000f-9710000000-b911cbbc994980c30d4a
Source of Spectrum CN112778068A
Wiley ID 1879851