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1-(4-Chlorophenyl)-N-(1-[4-(3-fluoropropoxy)-3,5-dimethoxyphenyl]propan-2-yl)methanimine
SpectraBase Compound ID JlGZ62qe93
InChI InChI=1S/C21H25ClFNO3/c1-15(24-14-16-5-7-18(22)8-6-16)11-17-12-19(25-2)21(20(13-17)26-3)27-10-4-9-23/h5-8,12-15H,4,9-11H2,1-3H3/b24-14+
InChIKey RRJOIGGDDCFABL-ZVHZXABRSA-N
Mol Weight 393.89 g/mol
Molecular Formula C21H25ClFNO3
Exact Mass 393.1507 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JHOUjno3SE4
Name 1-(4-Chlorophenyl)-N-(1-[4-(3-fluoropropoxy)-3,5-dimethoxyphenyl]propan-2-yl)methanimine
Classification Designer drug artifact
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 393.150699529 u
Formula C21H25ClFNO3
InChI InChI=1S/C21H25ClFNO3/c1-15(24-14-16-5-7-18(22)8-6-16)11-17-12-19(25-2)21(20(13-17)26-3)27-10-4-9-23/h5-8,12-15H,4,9-11H2,1-3H3/b24-14+
InChIKey RRJOIGGDDCFABL-ZVHZXABRSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 393.886 g/mol
Nominal Mass 393 u
Quality 944
Retention Index 2613
SMILES C1(=C(C=C(C=C1OC)CC(\N=C\C=1C=CC(=CC1)Cl)C)OC)OCCCF
SPLASH splash10-014i-1910000000-b1819e02ba0e8c3068cb
Sample Comments cis/trans isomerism uncertain
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms (4-chlorophenyl)-N-(1-(4-(3-fluoropropoxy)-3,5-dimethoxyphenyl)propan-2-yl)methanimine
Technique GC/MS
Wiley ID DD2024_020685