| SpectraBase Compound ID | Jq2Eu27BJ00 |
|---|---|
| InChI | InChI=1S/C17H17N/c1-4-16(14-8-6-5-7-9-14)15-10-12(2)17(18)13(3)11-15/h1,5-11,16H,18H2,2-3H3 |
| InChIKey | ODZCGHCKNOBEQD-UHFFFAOYSA-N |
| Mol Weight | 235.33 g/mol |
| Molecular Formula | C17H17N |
| Exact Mass | 235.1361 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9JC2vmB8RUI |
|---|---|
| Name | Benzenamine, 2,6-dimethyl-4-(1-phenyl-2-propynyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 235.136099551 u |
| Formula | C17H17N |
| InChI | InChI=1S/C17H17N/c1-4-16(14-8-6-5-7-9-14)15-10-12(2)17(18)13(3)11-15/h1,5-11,16H,18H2,2-3H3 |
| InChIKey | ODZCGHCKNOBEQD-UHFFFAOYSA-N |
| Molecular Weight | 235.330 g/mol |
| SMILES | C=1(C=C(C)C(=C(C1)C)N)C(C#C)C=1C=CC=CC1 |