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N,N-Bis(3-iodobenzyl)beta-methylbenzeneethanamine
SpectraBase Compound ID 4iCrC2b0LFy
InChI InChI=1S/C23H23I2N/c1-18(21-9-3-2-4-10-21)15-26(16-19-7-5-11-22(24)13-19)17-20-8-6-12-23(25)14-20/h2-14,18H,15-17H2,1H3
InChIKey DHWAPWNAGYWYCW-UHFFFAOYSA-N
Mol Weight 567.25 g/mol
Molecular Formula C23H23I2N
Exact Mass 566.99199 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2maMpnRc87E
Name N,N-Bis(3-iodobenzyl)beta-methylbenzeneethanamine
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 566.991989745 u
Formula C23H23I2N
InChI InChI=1S/C23H23I2N/c1-18(21-9-3-2-4-10-21)15-26(16-19-7-5-11-22(24)13-19)17-20-8-6-12-23(25)14-20/h2-14,18H,15-17H2,1H3
InChIKey DHWAPWNAGYWYCW-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 567.253 g/mol
Nominal Mass 567 u
Quality 995
Retention Index 3648
SMILES C(N(CC=1C=C(C=CC1)I)CC=1C=C(C=CC1)I)C(C=1C=CC=CC1)C
SPLASH splash10-03di-2130900000-9b8dcd1ca22ff22908d2
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N,N-Bis(3-iodobenzyl)beta-methylphenethylamine N,N-Bis(3-iodobenzyl)-2-phenylpropan-1-amine
Technique GC/MS
Wiley ID DD2024_021773