SpectraBase Compound ID | 4ccz7FwNi6v |
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InChI | InChI=1S/C10H14N2O/c1-3-11-10(13)12-9-7-5-4-6-8(9)2/h4-7H,3H2,1-2H3,(H2,11,12,13) |
InChIKey | NSRJDXXKOSLQKG-UHFFFAOYSA-N |
Mol Weight | 178.23 g/mol |
Molecular Formula | C10H14N2O |
Exact Mass | 178.110613 g/mol |
SpectraBase Spectrum ID | 8z2xBVBAX5L |
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Name | 1-Ethyl-3-o-tolylurea |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 178.110613078 u |
Formula | C10H14N2O |
InChI | InChI=1S/C10H14N2O/c1-3-11-10(13)12-9-7-5-4-6-8(9)2/h4-7H,3H2,1-2H3,(H2,11,12,13) |
InChIKey | NSRJDXXKOSLQKG-UHFFFAOYSA-N |
Molecular Weight | 178.235 g/mol |
SMILES | N(C1=CC=CC=C1C)C(NCC)=O |
Spectrum/Structure Validation Score (Raman) | 0.933037 |