| SpectraBase Compound ID | DVFA0r7o4kG |
|---|---|
| InChI | InChI=1S/C14H14/c1-11-7-9-13(10-8-11)14-6-4-3-5-12(14)2/h3-10H,1-2H3 |
| InChIKey | SHMKKPZGLDISGT-UHFFFAOYSA-N |
| Mol Weight | 182.27 g/mol |
| Molecular Formula | C14H14 |
| Exact Mass | 182.10955 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | HicCM7h4knX |
|---|---|
| Name | 1,1'-Biphenyl, 2,4'-dimethyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 182.109550451 u |
| Formula | C14H14 |
| InChI | InChI=1S/C14H14/c1-11-7-9-13(10-8-11)14-6-4-3-5-12(14)2/h3-10H,1-2H3 |
| InChIKey | SHMKKPZGLDISGT-UHFFFAOYSA-N |
| Molecular Weight | 182.266 g/mol |
| SMILES | C1(C)=C(C2=CC=C(C=C2)C)C=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.954515 |