SpectraBase Compound ID | cLgOVIMcm9 |
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InChI | InChI=1S/C13H14O/c1-13(2,14)12-8-7-10-5-3-4-6-11(10)9-12/h3-9,14H,1-2H3 |
InChIKey | CSONNHKIVVSLQQ-UHFFFAOYSA-N |
Mol Weight | 186.25 g/mol |
Molecular Formula | C13H14O |
Exact Mass | 186.104465 g/mol |
SpectraBase Spectrum ID | KsrsLqJX3Mz |
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Name | alpha,alpha-Dimethyl-2-naphthalenemethanol |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 186.104465070 u |
Formula | C13H14O |
InChI | InChI=1S/C13H14O/c1-13(2,14)12-8-7-10-5-3-4-6-11(10)9-12/h3-9,14H,1-2H3 |
InChIKey | CSONNHKIVVSLQQ-UHFFFAOYSA-N |
Molecular Weight | 186.254 g/mol |
SMILES | OC(C=1C=CC=2C=CC=CC2C1)(C)C |
Spectrum/Structure Validation Score (Raman) | 0.959004 |