| SpectraBase Spectrum ID |
L1Ox2W72Zxl |
| Name |
3-((2R,5S)-7-Benzyl-1-oxa-7-azaspiro[4.5]decan-2-yl)propanenitrile |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
284.188863400 u |
| Formula |
C18H24N2O |
| InChI |
InChI=1S/C18H24N2O/c19-12-4-8-17-9-11-18(21-17)10-5-13-20(15-18)14-16-6-2-1-3-7-16/h1-3,6-7,17H,4-5,8-11,13-15H2/t17-,18+/m1/s1 |
| InChIKey |
UYHMKNYBWZTYMP-MSOLQXFVSA-N |
| Molecular Weight |
284.403 g/mol |
| SMILES |
C(CC[C@]1(O[C@]2(CN(CCC2)CC2=CC=CC=C2)CC1)[H])#N |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.839642 |
![3-((2R,5S)-7-Benzyl-1-oxa-7-azaspiro[4.5]decan-2-yl)propanenitrile](/api/spectrum/L1Ox2W72Zxl/structure.png?h=300&w=458 "3-((2R,5S)-7-Benzyl-1-oxa-7-azaspiro[4.5]decan-2-yl)propanenitrile")
