SpectraBase Compound ID | 3u2RWSrBkZI |
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InChI | InChI=1S/C15H16O2/c16-12-11-15(17,13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,16-17H,11-12H2 |
InChIKey | RSDGWNARVDXTQA-UHFFFAOYSA-N |
Mol Weight | 228.29 g/mol |
Molecular Formula | C15H16O2 |
Exact Mass | 228.11503 g/mol |
SpectraBase Spectrum ID | HSRRobZlIMG |
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Name | 1,1-Diphenyl-1,3-propanediol |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 228.115029753 u |
Formula | C15H16O2 |
InChI | InChI=1S/C15H16O2/c16-12-11-15(17,13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,16-17H,11-12H2 |
InChIKey | RSDGWNARVDXTQA-UHFFFAOYSA-N |
Molecular Weight | 228.291 g/mol |
SMILES | OCCC(C1=CC=CC=C1)(C=1C=CC=CC1)O |
Spectrum/Structure Validation Score (Raman) | 0.996475 |