| SpectraBase Compound ID | 9yQ5gNJxPys |
|---|---|
| InChI | InChI=1S/C14H17BrN4O2/c1-14(2,3)11(12(16)20)17-13(21)10-8-6-7(15)4-5-9(8)18-19-10/h4-6,11H,1-3H3,(H2,16,20)(H,17,21)(H,18,19)/t11-/m1/s1 |
| InChIKey | AJGASUCDTSLMNP-LLVKDONJSA-N |
| Mol Weight | 353.22 g/mol |
| Molecular Formula | C14H17BrN4O2 |
| Exact Mass | 352.053489 g/mol |
Attenuated Total Reflectance Infrared (ATR-IR) Spectrum
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| SpectraBase Spectrum ID | IhJrzhXXVSa |
|---|---|
| Name | ADB-5Br-INACA |
| Source of Sample | Cayman Chemical Company |
| Catalog Number | 36263 |
| Lot Number | 0638474-3 |
| Accessory | DurasamplIR II |
| Apodization Function | Norton-Beer, medium |
| Copyright | Copyright © 2019-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H17BrN4O2 |
| InChI | InChI=1S/C14H17BrN4O2/c1-14(2,3)11(12(16)20)17-13(21)10-8-6-7(15)4-5-9(8)18-19-10/h4-6,11H,1-3H3,(H2,16,20)(H,17,21)(H,18,19)/t11-/m1/s1 |
| InChIKey | AJGASUCDTSLMNP-LLVKDONJSA-N |
| Instrument Name | Bio-Rad FTS |
| Molecular Weight | 353.220 g/mol |
| SMILES | [nH]1c2c(c(C(N[C@](C(N)=O)(C(C)(C)C)[H])=O)n1)cc(cc2)Br |
| Scan Speed (number) | 5 |
| Source of Spectrum | Forensic Spectral Research |
| Technique | ATR-Neat |