| SpectraBase Spectrum ID |
3MddvXXSUve |
| Name |
Pyrrolidine, 2-bytyl-1-methyl-5-nonyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
267.292600195 u |
| Formula |
C18H37N |
| InChI |
InChI=1S/C18H37N/c1-4-6-8-9-10-11-12-14-18-16-15-17(19(18)3)13-7-5-2/h17-18H,4-16H2,1-3H3 |
| InChIKey |
JLCLRGQSIIFLDM-UHFFFAOYSA-N |
| Molecular Weight |
267.501 g/mol |
| SMILES |
C1(N(C(CCCC)CC1)C)CCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.949518 |
