| SpectraBase Spectrum ID |
6DaASoOvs6S |
| Name |
(2S)-N-((S)-1-Phenylethyl)butan-2-amine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
177.151749616 u |
| Formula |
C12H19N |
| InChI |
InChI=1S/C12H19N/c1-4-10(2)13-11(3)12-8-6-5-7-9-12/h5-11,13H,4H2,1-3H3/t10-,11-/m0/s1 |
| InChIKey |
PXWVXIBJJNDWLW-QWRGUYRKSA-N |
| Molecular Weight |
177.291 g/mol |
| SMILES |
C([C@](C)(N[C@@](C)(C=1C=CC=CC1)[H])[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.962167 |
