| SpectraBase Spectrum ID |
DxPOuBB1TYs |
| Name |
(2R,3R)-1-Isopropyl-2-methyl-3-phenyl-aziridine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| 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] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.88825 |
