| SpectraBase Compound ID | 9A33sZWI2q6 |
|---|---|
| InChI | InChI=1S/C12H17N/c1-9(2)13-10(3)12(13)11-7-5-4-6-8-11/h4-10,12H,1-3H3/t10-,12+,13?/m1/s1 |
| InChIKey | NAVCMYOUFSTBGP-FVBASEICSA-N |
| Mol Weight | 175.27 g/mol |
| Molecular Formula | C12H17N |
| Exact Mass | 175.1361 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LAgWNEDeA4L |
|---|---|
| Name | (2R,3R)-1-Isopropyl-2-methyl-3-phenyl-aziridine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 175.136099551 u |
| Formula | C12H17N |
| InChI | InChI=1S/C12H17N/c1-9(2)13-10(3)12(13)11-7-5-4-6-8-11/h4-10,12H,1-3H3/t10-,12+,13?/m1/s1 |
| InChIKey | NAVCMYOUFSTBGP-FVBASEICSA-N |
| Molecular Weight | 175.275 g/mol |
| SMILES | [C@]1(N([C@@]1(C)[H])C(C)C)(C=1C=CC=CC1)[H] |