SpectraBase Compound ID | 6S0aPMmJjze |
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InChI | InChI=1S/C15H16/c1-3-13-9-5-7-11-15(13)14-10-6-4-8-12(14)2/h4-11H,3H2,1-2H3 |
InChIKey | QWBKPDHJCCYBLE-UHFFFAOYSA-N |
Mol Weight | 196.29 g/mol |
Molecular Formula | C15H16 |
Exact Mass | 196.125201 g/mol |
SpectraBase Spectrum ID | IhRRYX5cVa |
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Name | 2-Ethyl-2'-methylbiphenyl |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 196.125200515 u |
Formula | C15H16 |
InChI | InChI=1S/C15H16/c1-3-13-9-5-7-11-15(13)14-10-6-4-8-12(14)2/h4-11H,3H2,1-2H3 |
InChIKey | QWBKPDHJCCYBLE-UHFFFAOYSA-N |
Molecular Weight | 196.293 g/mol |
SMILES | CCC=1C(C2=C(C=CC=C2)C)=CC=CC1 |
Spectrum/Structure Validation Score (Raman) | 0.813339 |