SpectraBase Compound ID | BOg6OujG1TF |
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InChI | InChI=1S/C9H12N2O/c1-6-5-8(10)3-4-9(6)11-7(2)12/h3-5H,10H2,1-2H3,(H,11,12) |
InChIKey | GWFPMSIIVJMYRZ-UHFFFAOYSA-N |
Mol Weight | 164.21 g/mol |
Molecular Formula | C9H12N2O |
Exact Mass | 164.094963 g/mol |
SpectraBase Spectrum ID | DXgcYneMXjv |
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Name | 4'-Amino-o-acetotoluidide |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 164.094963013 u |
Formula | C9H12N2O |
InChI | InChI=1S/C9H12N2O/c1-6-5-8(10)3-4-9(6)11-7(2)12/h3-5H,10H2,1-2H3,(H,11,12) |
InChIKey | GWFPMSIIVJMYRZ-UHFFFAOYSA-N |
SMILES | NC1=CC(=C(C=C1)NC(C)=O)C |
Spectrum/Structure Validation Score (Raman) | 0.981984 |