SpectraBase Compound ID | 5vcdu42OJST |
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InChI | InChI=1S/C10H14O2/c1-2-3-8-12-10-6-4-9(11)5-7-10/h4-7,11H,2-3,8H2,1H3 |
InChIKey | MBGGFXOXUIDRJD-UHFFFAOYSA-N |
Mol Weight | 166.22 g/mol |
Molecular Formula | C10H14O2 |
Exact Mass | 166.09938 g/mol |
SpectraBase Spectrum ID | AYU2fCoInsr |
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Name | p-Butoxyphenol |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 166.099379689 u |
Formula | C10H14O2 |
InChI | InChI=1S/C10H14O2/c1-2-3-8-12-10-6-4-9(11)5-7-10/h4-7,11H,2-3,8H2,1H3 |
InChIKey | MBGGFXOXUIDRJD-UHFFFAOYSA-N |
Molecular Weight | 166.220 g/mol |
SMILES | OC1=CC=C(C=C1)OCCCC |
Spectrum/Structure Validation Score (Raman) | 0.79686 |