SpectraBase Compound ID | FWOWI1fgzgl |
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InChI | InChI=1S/C10H14/c1-5-10(4)8-6-7-9(2)3/h5-8H,1-2H2,3-4H3/b7-6+,10-8+ |
InChIKey | HPZWSJQQCJZBBG-LQPGMRSMSA-N |
Mol Weight | 134.22 g/mol |
Molecular Formula | C10H14 |
Exact Mass | 134.10955 g/mol |
SpectraBase Spectrum ID | xP1HFt1w39 |
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Name | 2,6-Dimethyl-1,3,5,7-octatetraene, E,E- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 134.109550451 u |
Formula | C10H14 |
InChI | InChI=1S/C10H14/c1-5-10(4)8-6-7-9(2)3/h5-8H,1-2H2,3-4H3/b7-6+,10-8+ |
InChIKey | HPZWSJQQCJZBBG-LQPGMRSMSA-N |
Molecular Weight | 134.222 g/mol |
SMILES | C=C(\C=C\C=C\(C=C)C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.946027 |