| SpectraBase Spectrum ID |
7eSs4vxTQbu |
| Name |
2-Heptyl-5-(5-hexenyl)pyrrolidine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
251.261300067 u |
| Formula |
C17H33N |
| InChI |
InChI=1S/C17H33N/c1-3-5-7-9-11-13-17-15-14-16(18-17)12-10-8-6-4-2/h4,16-18H,2-3,5-15H2,1H3 |
| InChIKey |
HVDZSXDKJFZLAK-UHFFFAOYSA-N |
| Molecular Weight |
251.458 g/mol |
| SMILES |
C1(NC(CC1)CCCCCCC)CCCCC=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.887164 |
