| SpectraBase Spectrum ID |
5u6E2GcGQKn |
| Name |
(2R,3S)-1-Benzyl-2,3-dimethylaziridine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
161.120449487 u |
| Formula |
C11H15N |
| InChI |
InChI=1S/C11H15N/c1-9-10(2)12(9)8-11-6-4-3-5-7-11/h3-7,9-10H,8H2,1-2H3/t9-,10+,12? |
| InChIKey |
BFXNQCMCFIVUFE-DHHPTOIESA-N |
| Molecular Weight |
161.248 g/mol |
| SMILES |
[C@]1(N([C@]1(C)[H])CC=1C=CC=CC1)(C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.937223 |
