SpectraBase Compound ID | KlDw4g7qAVU |
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InChI | InChI=1S/C10H18/c1-9(2)8-10-6-4-3-5-7-10/h4,6,9-10H,3,5,7-8H2,1-2H3 |
InChIKey | NVLNRIBMCIJLQD-UHFFFAOYSA-N |
Mol Weight | 138.25 g/mol |
Molecular Formula | C10H18 |
Exact Mass | 138.140851 g/mol |
SpectraBase Spectrum ID | Gl8CPkC8WxJ |
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Name | Cyclohexene, 3-(2-methylpropyl)- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 138.140850580 u |
Formula | C10H18 |
InChI | InChI=1S/C10H18/c1-9(2)8-10-6-4-3-5-7-10/h4,6,9-10H,3,5,7-8H2,1-2H3 |
InChIKey | NVLNRIBMCIJLQD-UHFFFAOYSA-N |
Molecular Weight | 138.254 g/mol |
SMILES | C(CC1CCCC=C1)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.930056 |