SpectraBase Compound ID | 3DAy5fJwFnN |
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InChI | InChI=1S/C12H20N2/c1-2-8-13(7-1)11-5-6-12-14-9-3-4-10-14/h1-4,7-12H2 |
InChIKey | JSUAJTLKVREZHV-UHFFFAOYSA-N |
Mol Weight | 192.31 g/mol |
Molecular Formula | C12H20N2 |
Exact Mass | 192.162649 g/mol |
SpectraBase Spectrum ID | GCaJQ3aKyAD |
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Name | Tremorine |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 192.162648652 u |
Formula | C12H20N2 |
InChI | InChI=1S/C12H20N2/c1-2-8-13(7-1)11-5-6-12-14-9-3-4-10-14/h1-4,7-12H2 |
InChIKey | JSUAJTLKVREZHV-UHFFFAOYSA-N |
Molecular Weight | 192.306 g/mol |
SMILES | C(C#CCN1CCCC1)N1CCCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.86768 |