SpectraBase Compound ID | CfksGfuA9DS |
---|---|
InChI | InChI=1S/C13H16O/c14-13(11-6-7-11,12-8-9-12)10-4-2-1-3-5-10/h1-5,11-12,14H,6-9H2 |
InChIKey | FOGMKFIZSXPVNT-UHFFFAOYSA-N |
Mol Weight | 188.27 g/mol |
Molecular Formula | C13H16O |
Exact Mass | 188.120115 g/mol |
SpectraBase Spectrum ID | HyyDhWUniwm |
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Name | alpha,alpha-Dicyclopropylbenzyl alcohol |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 188.120115134 u |
Formula | C13H16O |
InChI | InChI=1S/C13H16O/c14-13(11-6-7-11,12-8-9-12)10-4-2-1-3-5-10/h1-5,11-12,14H,6-9H2 |
InChIKey | FOGMKFIZSXPVNT-UHFFFAOYSA-N |
Molecular Weight | 188.270 g/mol |
SMILES | OC(C1=CC=CC=C1)(C1CC1)C1CC1 |
Spectrum/Structure Validation Score (Raman) | 0.993481 |