SpectraBase Compound ID | 2uqVXuTcVVp |
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InChI | InChI=1S/C10H16O/c1-10(11-2)8-3-4-9(10)7-5-6(7)8/h6-9H,3-5H2,1-2H3 |
InChIKey | XPLUTCPWBBVOJI-UHFFFAOYSA-N |
Mol Weight | 152.24 g/mol |
Molecular Formula | C10H16O |
Exact Mass | 152.120115 g/mol |
SpectraBase Spectrum ID | 5oZ9tGXZAGw |
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Name | syn-8-Methoxy-8-methyl-endo-tricyclo[3.2.1.0(2,4)]octane |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 152.120115134 u |
Formula | C10H16O |
InChI | InChI=1S/C10H16O/c1-10(11-2)8-3-4-9(10)7-5-6(7)8/h6-9H,3-5H2,1-2H3 |
InChIKey | XPLUTCPWBBVOJI-UHFFFAOYSA-N |
Molecular Weight | 152.237 g/mol |
SMILES | C12C(C3C(C2CC3)(OC)C)C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.968461 |