![1H-tetrazol-5-amine, 1-methyl-N-[(2E)-3-phenyl-2-propenyl]-](/api/spectrum/Jce1a3oWZLm/structure.png?h=300&w=458 "1H-tetrazol-5-amine, 1-methyl-N-[(2E)-3-phenyl-2-propenyl]-")
| SpectraBase Compound ID | GmXspu068nR |
|---|---|
| InChI | InChI=1S/C11H13N5/c1-16-11(13-14-15-16)12-9-5-8-10-6-3-2-4-7-10/h2-8H,9H2,1H3,(H,12,13,15)/b8-5+ |
| InChIKey | MMVHDJCIVZPFAJ-VMPITWQZSA-N |
| Mol Weight | 215.26 g/mol |
| Molecular Formula | C11H13N5 |
| Exact Mass | 215.117095 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Jce1a3oWZLm |
|---|---|
| Name | 1H-Tetrazol-5-amine, 1-methyl-N-[(2E)-3-phenyl-2-propenyl]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 215.117095439 u |
| Formula | C11H13N5 |
| InChI | InChI=1S/C11H13N5/c1-16-11(13-14-15-16)12-9-5-8-10-6-3-2-4-7-10/h2-8H,9H2,1H3,(H,12,13,15)/b8-5+ |
| InChIKey | MMVHDJCIVZPFAJ-VMPITWQZSA-N |
| SMILES | N(C=1N(N=NN1)C)C\C=C\C=1C=CC=CC1 |