SpectraBase Compound ID | A1pJW41vDC1 |
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InChI | InChI=1S/C10H18/c1-3-9(2)10-7-5-4-6-8-10/h5,7,9-10H,3-4,6,8H2,1-2H3 |
InChIKey | MSLGIVAKKFSXBC-UHFFFAOYSA-N |
Mol Weight | 138.25 g/mol |
Molecular Formula | C10H18 |
Exact Mass | 138.140851 g/mol |
SpectraBase Spectrum ID | 76TLnwOyvFZ |
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Name | Cyclohexene,3-(1-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/c1-3-9(2)10-7-5-4-6-8-10/h5,7,9-10H,3-4,6,8H2,1-2H3 |
InChIKey | MSLGIVAKKFSXBC-UHFFFAOYSA-N |
Molecular Weight | 138.254 g/mol |
SMILES | C1CCC(C=C1)C(CC)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.941909 |