| SpectraBase Spectrum ID |
6JA6AbpsZmL |
| Name |
Benzamide, 2-methyl-N-nonyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
261.209264492 u |
| Formula |
C17H27NO |
| InChI |
InChI=1S/C17H27NO/c1-3-4-5-6-7-8-11-14-18-17(19)16-13-10-9-12-15(16)2/h9-10,12-13H,3-8,11,14H2,1-2H3,(H,18,19) |
| InChIKey |
UEVCPOQGIDKBCV-UHFFFAOYSA-N |
| Molecular Weight |
261.409 g/mol |
| SMILES |
C(NCCCCCCCCC)(=O)C=1C=CC=CC1C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.946533 |