SpectraBase Compound ID | 3RT50pvC4f0 |
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InChI | InChI=1S/C15H24/c1-7-14(6)9-8-12-13(4,5)10-15(12,14)11(2)3/h7,12H,1-2,8-10H2,3-6H3 |
InChIKey | UAOBSVDFJSNTLJ-UHFFFAOYSA-N |
Mol Weight | 204.36 g/mol |
Molecular Formula | C15H24 |
Exact Mass | 204.187801 g/mol |
SpectraBase Spectrum ID | L8OCTvODWhD |
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Name | Panaxene |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 204.187800773 u |
Formula | C15H24 |
InChI | InChI=1S/C15H24/c1-7-14(6)9-8-12-13(4,5)10-15(12,14)11(2)3/h7,12H,1-2,8-10H2,3-6H3 |
InChIKey | UAOBSVDFJSNTLJ-UHFFFAOYSA-N |
Molecular Weight | 204.357 g/mol |
SMILES | C12(C(CCC2C(C1)(C)C)(C)C=C)C(=C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.862958 |