| SpectraBase Compound ID | DlYbIHkCzps |
|---|---|
| InChI | InChI=1S/C30H50/c1-26(2)15-8-17-29(6)22-11-13-25-28(5,20-21(22)10-12-23(26)29)19-14-24-27(3,4)16-9-18-30(24,25)7/h10,22-25H,8-9,11-20H2,1-7H3/t22?,23?,24?,25?,28-,29+,30-/m0/s1 |
| InChIKey | NIALLGCBSYYMNQ-BAHOWBOISA-N |
| Mol Weight | 410.7 g/mol |
| Molecular Formula | C30H50 |
| Exact Mass | 410.391252 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 6zMYOPwz6E9 |
|---|---|
| Name | Serrat-14-ene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 410.391251610 u |
| Formula | C30H50 |
| InChI | InChI=1S/C30H50/c1-26(2)15-8-17-29(6)22-11-13-25-28(5,20-21(22)10-12-23(26)29)19-14-24-27(3,4)16-9-18-30(24,25)7/h10,22-25H,8-9,11-20H2,1-7H3/t22?,23?,24?,25?,28-,29+,30-/m0/s1 |
| InChIKey | NIALLGCBSYYMNQ-BAHOWBOISA-N |
| Molecular Weight | 410.730 g/mol |
| SMILES | [C@]12(C3[C@@](CC4=CCC5[C@@](C4CC3)(CCCC5(C)C)C)(C)CCC1C(C)(C)CCC2)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.899874 |