SpectraBase Compound ID | D8yxHo4bcFt |
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InChI | InChI=1S/C11H20O/c1-5-9-8(2)10(12)6-7-11(9,3)4/h9,12H,5-7H2,1-4H3 |
InChIKey | BDHRZIBVALZKJI-UHFFFAOYSA-N |
Mol Weight | 168.28 g/mol |
Molecular Formula | C11H20O |
Exact Mass | 168.151415 g/mol |
SpectraBase Spectrum ID | CNj08qlDMVE |
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Name | Pinocamphenol |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 168.151415263 u |
Formula | C11H20O |
InChI | InChI=1S/C11H20O/c1-5-9-8(2)10(12)6-7-11(9,3)4/h9,12H,5-7H2,1-4H3 |
InChIKey | BDHRZIBVALZKJI-UHFFFAOYSA-N |
Molecular Weight | 168.280 g/mol |
SMILES | C1(C(=C(CCC1(C)C)O)C)CC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.968772 |