| SpectraBase Compound ID | T40uU0dJku |
|---|---|
| InChI | InChI=1S/C17H20BrN3O/c1-17(2,3)16(22)15(21-12-19-11-20-21)6-4-5-13-7-9-14(18)10-8-13/h4-5,7-12,15H,6H2,1-3H3/b5-4+ |
| InChIKey | MVVRWWAXIGYGFG-SNAWJCMRSA-N |
| Mol Weight | 362.27 g/mol |
| Molecular Formula | C17H20BrN3O |
| Exact Mass | 361.078975 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | Eg9jrGsnkuT |
|---|---|
| Name | 6-Hepten-3-one, 7-(4-bromophenyl)-2,2-dimethyl-4-(1H-1,2,4-triazol-1-yl)- |
| CAS Registry Number | 105708-24-5 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C17H20BrN3O |
| InChI | InChI=1S/C17H20BrN3O/c1-17(2,3)16(22)15(21-12-19-11-20-21)6-4-5-13-7-9-14(18)10-8-13/h4-5,7-12,15H,6H2,1-3H3/b5-4+ |
| InChIKey | MVVRWWAXIGYGFG-SNAWJCMRSA-N |
| Instrument Name | Bruker IFS 85 |
| Purity | slightly contaminated |
| Technique | Film |