| SpectraBase Spectrum ID |
JQlIkNOwXrC |
| Name |
Azacyclohexadecan-2-one, 1-(phenylmethyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
329.271864750 u |
| Formula |
C22H35NO |
| InChI |
InChI=1S/C22H35NO/c24-22-18-14-9-7-5-3-1-2-4-6-8-10-15-19-23(22)20-21-16-12-11-13-17-21/h11-13,16-17H,1-10,14-15,18-20H2 |
| InChIKey |
WEUHTTHNENOJQH-UHFFFAOYSA-N |
| Molecular Weight |
329.528 g/mol |
| SMILES |
C1(N(CCCCCCCCCCCCCC1)CC=1C=CC=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.860688 |
