| SpectraBase Compound ID | JcvOOlOzIvP |
|---|---|
| InChI | InChI=1S/C16H34/c1-4-7-9-11-14-16(13-6-3)15-12-10-8-5-2/h16H,4-15H2,1-3H3 |
| InChIKey | VIPXLNQRBDOQFP-UHFFFAOYSA-N |
| Mol Weight | 226.4 g/mol |
| Molecular Formula | C16H34 |
| Exact Mass | 226.266051 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | JYlBpoBcY9Z |
|---|---|
| Name | Tridecane, 7-propyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 226.266051095 u |
| Formula | C16H34 |
| InChI | InChI=1S/C16H34/c1-4-7-9-11-14-16(13-6-3)15-12-10-8-5-2/h16H,4-15H2,1-3H3 |
| InChIKey | VIPXLNQRBDOQFP-UHFFFAOYSA-N |
| Molecular Weight | 226.448 g/mol |
| SMILES | C(C(CCCCCC)CCC)CCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.851949 |