| SpectraBase Compound ID | 6rvScVBn3kV |
|---|---|
| InChI | InChI=1S/C21H36/c1-3-13-20-16(7-1)9-5-11-18(20)15-19-12-6-10-17-8-2-4-14-21(17)19/h16-21H,1-15H2 |
| InChIKey | XUXHXEMDOZHKDH-UHFFFAOYSA-N |
| Mol Weight | 288.5 g/mol |
| Molecular Formula | C21H36 |
| Exact Mass | 288.281701 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 93n45h5J439 |
|---|---|
| Name | Naphthalene, 1,1'-methylenebis[decahydro- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 288.281701159 u |
| Formula | C21H36 |
| InChI | InChI=1S/C21H36/c1-3-13-20-16(7-1)9-5-11-18(20)15-19-12-6-10-17-8-2-4-14-21(17)19/h16-21H,1-15H2 |
| InChIKey | XUXHXEMDOZHKDH-UHFFFAOYSA-N |
| SMILES | C1(CC2C3C(CCC2)CCCC3)C2C(CCC1)CCCC2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.959963 |