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N-(1-(4-Fluoro-2H-1,3-benzodioxol-5-yl)propan-2-yl)-1-(3-methoxyphenyl)methanimine
SpectraBase Compound ID BA2jD3tMQFH
InChI InChI=1S/C18H18FNO3/c1-12(20-10-13-4-3-5-15(9-13)21-2)8-14-6-7-16-18(17(14)19)23-11-22-16/h3-7,9-10,12H,8,11H2,1-2H3/b20-10+
InChIKey GJHSZPLZDBIGAX-KEBDBYFISA-N
Mol Weight 315.34 g/mol
Molecular Formula C18H18FNO3
Exact Mass 315.127072 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JIwQntQ39Wq
Name N-(1-(4-Fluoro-2H-1,3-benzodioxol-5-yl)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 315.127071604 u
Formula C18H18FNO3
InChI InChI=1S/C18H18FNO3/c1-12(20-10-13-4-3-5-15(9-13)21-2)8-14-6-7-16-18(17(14)19)23-11-22-16/h3-7,9-10,12H,8,11H2,1-2H3/b20-10+
InChIKey GJHSZPLZDBIGAX-KEBDBYFISA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 315.344 g/mol
Nominal Mass 315 u
Quality 978
Retention Index 2297
SMILES C12=C(C(=CC=C2OCO1)CC(\N=C\C=1C=C(C=CC1)OC)C)F
SPLASH splash10-03di-1900000000-b45117a8d221ccca7790
Sample Comments cis/trans isomerism uncertain
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(1-(4-ethoxy-3,5-dimethoxyphenyl)propan-2-yl)(3-methoxyphenyl)methanimine
Technique GC/MS
Wiley ID DD2024_021538