![1,3,5-Trimethylpyrazolo[3',4':6,7]azepino[5,4,3-cd]indole](/api/spectrum/9tSvhyGIaRx/structure.png?h=300&w=458 "1,3,5-Trimethylpyrazolo[3',4':6,7]azepino[5,4,3-cd]indole")
| SpectraBase Compound ID | 2BxPGLyorB8 |
|---|---|
| InChI | InChI=1S/C15H14N4/c1-8-10-5-4-6-12-13(10)11(7-16-12)15-14(17-8)9(2)18-19(15)3/h4-7,16H,1-3H3 |
| InChIKey | WOKYOJXAXAOSNK-UHFFFAOYSA-N |
| Mol Weight | 250.3 g/mol |
| Molecular Formula | C15H14N4 |
| Exact Mass | 250.121846 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9tSvhyGIaRx |
|---|---|
| Name | 1,3,5-Trimethylpyrazolo[3',4':6,7]azepino[5,4,3-cd]indole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 250.121846467 u |
| Formula | C15H14N4 |
| InChI | InChI=1S/C15H14N4/c1-8-10-5-4-6-12-13(10)11(7-16-12)15-14(17-8)9(2)18-19(15)3/h4-7,16H,1-3H3 |
| InChIKey | WOKYOJXAXAOSNK-UHFFFAOYSA-N |
| Molecular Weight | 250.305 g/mol |
| SMILES | C12=C(C=3C=4C(=CC=CC4C(=N2)C)NC3)N(C)N=C1C |