Debug Info

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11rEh8ibB2
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11rEh8ibB2
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N-(3-Iodobenzyl)-2,4-dichlorobenzeneethanamine
SpectraBase Compound ID BnlUHjJIszV
InChI InChI=1S/C15H14Cl2IN/c16-13-5-4-12(15(17)9-13)6-7-19-10-11-2-1-3-14(18)8-11/h1-5,8-9,19H,6-7,10H2
InChIKey ZARUVOIJUAIQDH-UHFFFAOYSA-N
Mol Weight 406.09 g/mol
Molecular Formula C15H14Cl2IN
Exact Mass 404.9548 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 11rEh8ibB2
Name N-(3-Iodobenzyl)-2,4-dichlorobenzeneethanamine
Classification Chemical
Copyright Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 404.954799855 u
Formula C15H14Cl2IN
InChI InChI=1S/C15H14Cl2IN/c16-13-5-4-12(15(17)9-13)6-7-19-10-11-2-1-3-14(18)8-11/h1-5,8-9,19H,6-7,10H2
InChIKey ZARUVOIJUAIQDH-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 406.094 g/mol
Nominal Mass 405 u
Quality 982
Retention Index 2616
SMILES C=1(C(=CC(=CC1)Cl)Cl)CCNCC=1C=C(C=CC1)I
SPLASH splash10-00kb-3190000000-ea033315ab2dc20e4525
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(3-Iodobenzyl)-2,4-dichlorophenethylamine 2-(2,4-dichlorophenyl)-N-(3-iodobenzyl)ethan-1-amine
Technique GC/MS
Wiley ID DD2024_021772
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