SpectraBase Spectrum ID |
kthUkuEmBR |
Name |
Piperazine, 1-[(5-bromo-3-pyridinyl)carbonyl]-4-(phenylmethyl)- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
359.063325211 u |
Formula |
C17H18BrN3O |
InChI |
InChI=1S/C17H18BrN3O/c18-16-10-15(11-19-12-16)17(22)21-8-6-20(7-9-21)13-14-4-2-1-3-5-14/h1-5,10-12H,6-9,13H2 |
InChIKey |
RFYSOVQOHGBFCG-UHFFFAOYSA-N |
Molecular Weight |
360.255 g/mol |
SMILES |
C(C=1C=C(Br)C=NC1)(N1CCN(CC1)CC=1C=CC=CC1)=O |