| SpectraBase Spectrum ID |
DN0WpGRTyrd |
| Name |
Heptadecane, 8,8-dipentyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
380.438201803 u |
| Formula |
C27H56 |
| InChI |
InChI=1S/C27H56/c1-5-9-13-15-16-18-22-26-27(23-19-11-7-3,24-20-12-8-4)25-21-17-14-10-6-2/h5-26H2,1-4H3 |
| InChIKey |
FFNPPILCLWBBLT-UHFFFAOYSA-N |
| Molecular Weight |
380.745 g/mol |
| SMILES |
C(C(CCCCCCC)(CCCCC)CCCCC)CCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.940133 |
