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3-Fluoro-N-(3-iodobenzyl)aniline
SpectraBase Compound ID Df2rrsuMLTD
InChI InChI=1S/C13H11FIN/c14-11-4-2-6-13(8-11)16-9-10-3-1-5-12(15)7-10/h1-8,16H,9H2
InChIKey AYURQOATHVXRRT-UHFFFAOYSA-N
Mol Weight 327.14 g/mol
Molecular Formula C13H11FIN
Exact Mass 326.992023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6zRhpvDnxEn
Name 3-Fluoro-N-(3-iodobenzyl)aniline
Classification Chemical
Copyright Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 326.992022521 u
Formula C13H11FIN
InChI InChI=1S/C13H11FIN/c14-11-4-2-6-13(8-11)16-9-10-3-1-5-12(15)7-10/h1-8,16H,9H2
InChIKey AYURQOATHVXRRT-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 327.141 g/mol
Nominal Mass 327 u
Quality 991
Retention Index 2124
SMILES C1(NCC2=CC(=CC=C2)I)=CC(=CC=C1)F
SPLASH splash10-00or-9558000000-0b302f85d1aaeb1f9b1e
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Wiley ID DD2024_028462