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N-[2-(3-Bromophenyl)ethyl]-4-methylbenzamide
SpectraBase Compound ID EPB0zyJLFLZ
InChI InChI=1S/C16H16BrNO/c1-12-5-7-14(8-6-12)16(19)18-10-9-13-3-2-4-15(17)11-13/h2-8,11H,9-10H2,1H3,(H,18,19)
InChIKey XYHCPQDDYLKDHY-UHFFFAOYSA-N
Mol Weight 318.21 g/mol
Molecular Formula C16H16BrNO
Exact Mass 317.041527 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8I2gBeLNjWq
Name N-[2-(3-Bromophenyl)ethyl]-4-methylbenzamide
Classification Chemical
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 317.041527138 u
Formula C16H16BrNO
InChI InChI=1S/C16H16BrNO/c1-12-5-7-14(8-6-12)16(19)18-10-9-13-3-2-4-15(17)11-13/h2-8,11H,9-10H2,1H3,(H,18,19)
InChIKey XYHCPQDDYLKDHY-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 318.214 g/mol
Nominal Mass 317 u
Quality 988
Retention Index 2609
SMILES C(C=1C=CC(=CC1)C)(NCCC=1C=C(C=CC1)Br)=O
SPLASH splash10-014i-2901000000-1374e7bf081df7bc15b0
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Wiley ID DD2024_030222