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1-(4-Chlorophenyl)-N-(1-[4-methoxy-3-methylthiophenyl]propan-2-yl)methanimine
SpectraBase Compound ID Kzcyhj9qyWc
InChI InChI=1S/C18H20ClNOS/c1-13(20-12-14-4-7-16(19)8-5-14)10-15-6-9-17(21-2)18(11-15)22-3/h4-9,11-13H,10H2,1-3H3/b20-12+
InChIKey IXBVWJZXXKBSSR-UDWIEESQSA-N
Mol Weight 333.88 g/mol
Molecular Formula C18H20ClNOS
Exact Mass 333.095413 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DmTeNwYJeca
Name 1-(4-Chlorophenyl)-N-(1-[4-methoxy-3-methylthiophenyl]propan-2-yl)methanimine
Classification Designer drug artifact
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 333.095413141 u
Formula C18H20ClNOS
InChI InChI=1S/C18H20ClNOS/c1-13(20-12-14-4-7-16(19)8-5-14)10-15-6-9-17(21-2)18(11-15)22-3/h4-9,11-13H,10H2,1-3H3/b20-12+
InChIKey IXBVWJZXXKBSSR-UDWIEESQSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 333.877 g/mol
Nominal Mass 333 u
Quality 978
Retention Index 2497
SMILES C1(=CC(=C(C=C1)OC)SC)CC(\N=C\C=1C=CC(=CC1)Cl)C
SPLASH splash10-014i-1900000000-414c303bbc6a2bc896e4
Sample Comments cis/trans isomerism uncertain
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms (4-chlorophenyl)-N-(1-(4-methoxy-3-methylthiophenyl)propan-2-yl)methanimine
Technique GC/MS
Wiley ID DD2024_020640