SpectraBase Compound ID | 5sGOOa8Ow01 |
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InChI | InChI=1S/C14H22/c1-2-4-11(5-3-1)8-14-10-12-6-7-13(14)9-12/h8,12-14H,1-7,9-10H2 |
InChIKey | CJWHOIPGTALIAL-UHFFFAOYSA-N |
Mol Weight | 190.33 g/mol |
Molecular Formula | C14H22 |
Exact Mass | 190.172151 g/mol |
SpectraBase Spectrum ID | LmdaHbAZ0J3 |
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Name | 2-(Cyclohexylidenemethyl)bicyclo[2.2.1]heptane |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 190.172150708 u |
Formula | C14H22 |
InChI | InChI=1S/C14H22/c1-2-4-11(5-3-1)8-14-10-12-6-7-13(14)9-12/h8,12-14H,1-7,9-10H2 |
InChIKey | CJWHOIPGTALIAL-UHFFFAOYSA-N |
Molecular Weight | 190.330 g/mol |
SMILES | C1CC2CC1C(C=C1CCCCC1)C2 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.87461 |