| SpectraBase Spectrum ID |
3p6jVQ7vB8Z |
| Name |
(E)-1-[1-(4-Bromophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-3-phenylprop-2-en-1-one |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
367.032025082 u |
| Formula |
C18H14BrN3O |
| InChI |
InChI=1S/C18H14BrN3O/c1-13-18(17(23)12-7-14-5-3-2-4-6-14)20-21-22(13)16-10-8-15(19)9-11-16/h2-12H,1H3/b12-7+ |
| InChIKey |
PXPRCASEUDIQNT-KPKJPENVSA-N |
| Molecular Weight |
368.234 g/mol |
| SMILES |
C=1(N=NN(C1C)C=1C=CC(=CC1)Br)C(\C=C\C1=CC=CC=C1)=O |
![(E)-1-[1-(4-Bromophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-3-phenylprop-2-en-1-one](/api/spectrum/3p6jVQ7vB8Z/structure.png?h=300&w=458 "(E)-1-[1-(4-Bromophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-3-phenylprop-2-en-1-one")
