SpectraBase Spectrum ID |
2muLTpyVyam |
Name |
N-[1-(4-Bromophenyl)ethyl]-3-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/c1-11-4-3-5-14(10-11)16(19)18-12(2)13-6-8-15(17)9-7-13/h3-10,12H,1-2H3,(H,18,19) |
InChIKey |
YYFGEQGWPMGWOU-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
318.214 g/mol |
Nominal Mass |
317 u |
Quality |
974 |
Retention Index |
2442 |
SMILES |
C(NC(C1=CC=C(C=C1)Br)C)(C=1C=C(C=CC1)C)=O |
SPLASH |
splash10-014i-3903000000-1a20b93d9afc3d2dd18a |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Technique |
GC/MS |
Wiley ID |
DD2024_023195 |