SpectraBase Spectrum ID |
8KEnzKleXIm |
Name |
N-[1-(4-Bromophenyl)ethyl]-4-propylbenzamide |
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 |
345.072827267 u |
Formula |
C18H20BrNO |
InChI |
InChI=1S/C18H20BrNO/c1-3-4-14-5-7-16(8-6-14)18(21)20-13(2)15-9-11-17(19)12-10-15/h5-13H,3-4H2,1-2H3,(H,20,21) |
InChIKey |
IZTUSTFPXJPDKC-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
346.268 g/mol |
Nominal Mass |
345 u |
Quality |
990 |
Retention Index |
2442 |
SMILES |
C(NC(C=1C=CC(=CC1)Br)C)(C=1C=CC(=CC1)CCC)=O |
SPLASH |
splash10-0002-2902000000-913914b523b5b10e67aa |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Technique |
GC/MS |
Wiley ID |
DD2024_030255 |