SpectraBase Compound ID | LN6jIpMBFZ3 |
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InChI | InChI=1S/C10H18O/c1-10(2,8-11)9-6-4-3-5-7-9/h6,11H,3-5,7-8H2,1-2H3 |
InChIKey | KDKALIXKMRWQLR-UHFFFAOYSA-N |
Mol Weight | 154.25 g/mol |
Molecular Formula | C10H18O |
Exact Mass | 154.135765 g/mol |
SpectraBase Spectrum ID | DSDBV8KzVfQ |
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Name | 2-(1-Cyclohexenyl)-2-methyl-1-propanol |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 154.135765199 u |
Formula | C10H18O |
InChI | InChI=1S/C10H18O/c1-10(2,8-11)9-6-4-3-5-7-9/h6,11H,3-5,7-8H2,1-2H3 |
InChIKey | KDKALIXKMRWQLR-UHFFFAOYSA-N |
Molecular Weight | 154.253 g/mol |
SMILES | C1(C(CO)(C)C)=CCCCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.914896 |