SpectraBase Compound ID | IY5OE1buvvA |
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InChI | InChI=1S/C13H14BrN3O/c14-12-4-1-3-11(9-12)13(18)16-5-2-7-17-8-6-15-10-17/h1,3-4,6,8-10H,2,5,7H2,(H,16,18) |
InChIKey | XZCCNNHZNYRVBP-UHFFFAOYSA-N |
Mol Weight | 308.18 g/mol |
Molecular Formula | C13H14BrN3O |
Exact Mass | 307.032025 g/mol |
SpectraBase Spectrum ID | HDzhhRL8kfB |
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Name | 3-bromo-N-[3-(1H-imidazol-1-yl)propyl]benzamide |
Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 307.032025082 u |
Formula | C13H14BrN3O |
InChI | InChI=1S/C13H14BrN3O/c14-12-4-1-3-11(9-12)13(18)16-5-2-7-17-8-6-15-10-17/h1,3-4,6,8-10H,2,5,7H2,(H,16,18) |
InChIKey | XZCCNNHZNYRVBP-UHFFFAOYSA-N |
Molecular Weight | 308.179 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2020_5041 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/12318227 |