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N-(1-(4-Ethyl-2-methoxy-5-methylthiophenyl)propan-2-yl)-1-(3-methoxyphenyl)methanimine
SpectraBase Compound ID LxvhgNIXZiR
InChI InChI=1S/C21H27NO2S/c1-6-17-12-20(24-4)18(13-21(17)25-5)10-15(2)22-14-16-8-7-9-19(11-16)23-3/h7-9,11-15H,6,10H2,1-5H3/b22-14+
InChIKey PWZSCJCOMOPJLE-HYARGMPZSA-N
Mol Weight 357.51 g/mol
Molecular Formula C21H27NO2S
Exact Mass 357.17625 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JH4KcITshrU
Name N-(1-(4-Ethyl-2-methoxy-5-methylthiophenyl)propan-2-yl)-1-(3-methoxyphenyl)methanimine
Classification Designer drug artifact
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 357.176250285 u
Formula C21H27NO2S
InChI InChI=1S/C21H27NO2S/c1-6-17-12-20(24-4)18(13-21(17)25-5)10-15(2)22-14-16-8-7-9-19(11-16)23-3/h7-9,11-15H,6,10H2,1-5H3/b22-14+
InChIKey PWZSCJCOMOPJLE-HYARGMPZSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 357.512 g/mol
Nominal Mass 357 u
Quality 984
Retention Index 2599
SMILES C=1(C(=CC(=C(C1)SC)CC)OC)CC(\N=C\C=1C=C(C=CC1)OC)C
SPLASH splash10-03di-0901000000-9add2fa7624b8883e5e7
Sample Comments cis/trans isomerism uncertain
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(1-(4-ethyl-2-methoxy-5-methylthiophenyl)propan-2-yl)(3-methoxyphenyl)methanimine
Technique GC/MS
Wiley ID DD2024_021492